Matches any text strings used to describe a molecule.
Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
Additional Filters

Found 5 results

Search term: IQPKXBNXMQCSRI (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2604893

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C18H19ClN4/c1-12-8-9-20-17(10-12)21-18(15-4-6-16(19)7-5-15)23-14(3)11-13(2)22-23/h4-11,18H,1-3H3,(H,20,21)
C18H19ClN4326.823312600
593066

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H19ClN4/c1-12-8-9-20-17(10-12)21-18(15-4-6-16(19)7-5-15)23-14(3)11-13(2)22-23/h4-11,18H,1-3H3,(H,20,21)/t18-/m1/s1
C18H19ClN4326.82332100
593067

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H19ClN4/c1-12-8-9-20-17(10-12)21-18(15-4-6-16(19)7-5-15)23-14(3)11-13(2)22-23/h4-11,18H,1-3H3,(H,20,21)/t18-/m0/s1
C18H19ClN4326.82332100
6098063

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H19ClN4/c1-12-8-9-20-17(10-12)21-18(15-4-6-16(19)7-5-15)23-14(3)11-13(2)22-23/h4-11,18H,1-3H3,(H,20,21)/p+1/t18-/m1/s1
C18H20ClN4327.83071100
6098064

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H19ClN4/c1-12-8-9-20-17(10-12)21-18(15-4-6-16(19)7-5-15)23-14(3)11-13(2)22-23/h4-11,18H,1-3H3,(H,20,21)/p+1/t18-/m0/s1
C18H20ClN4327.83071100

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