2-(2,9-dimethyl-1-oxidanylidene-4,5-dihydro-3H-azepino[3,4-b]indol-10-yl)ethanoic acid

Systemtic Name: 2-(2,9-dimethyl-1-oxidanylidene-4,5-dihydro-3H-azepino[3,4-b]indol-10-yl)ethanoic acid Openeye Name: 2-(2,9-dimethyl-1-oxo-4,5-dihydro-3H-azepino[3,4-b]indol-10-yl)acetic acid CAS Name: 2-(2,9-dimethyl-1-oxo-4,5-dihydro-3H-azepino[3,4-b]indol-10-yl)acetic acid IUPAC Name: 2-(2,9-dimethyl-1-oxo-4,5-dihydro-3H-azepino[3,4-b]indol-10-yl)acetic acid Traditional Name: 2-(1-keto-2,9-dimethyl-4,5-dihydro-3H-azepin[3,4-b]indol-10-yl)acetic acid Formula: C16H18N2O3 MolecularWeight: 286.32572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N(C3=C2CCCN(C3=O)C)CC(=O)O

Isomeric SMILES

CC1=CC=CC2=C1N(C3=C2CCCN(C3=O)C)CC(=O)O

InChI

InChI=1S/C16H18N2O3/c1-10-5-3-6-11-12-7-4-8-17(2)16(21)15(12)18(14(10)11)9-13(19)20/h3,5-6H,4,7-9H2,1-2H3,(H,19,20)