2-(2,8,9-trimethyl-1-oxidanylidene-4,5-dihydro-3H-azepino[3,4-b]indol-10-yl)ethanoic acid

Systemtic Name: 2-(2,8,9-trimethyl-1-oxidanylidene-4,5-dihydro-3H-azepino[3,4-b]indol-10-yl)ethanoic acid Openeye Name: 2-(2,8,9-trimethyl-1-oxo-4,5-dihydro-3H-azepino[3,4-b]indol-10-yl)acetic acid CAS Name: 2-(2,8,9-trimethyl-1-oxo-4,5-dihydro-3H-azepino[3,4-b]indol-10-yl)acetic acid IUPAC Name: 2-(2,8,9-trimethyl-1-oxo-4,5-dihydro-3H-azepino[3,4-b]indol-10-yl)acetic acid Traditional Name: 2-(1-keto-2,8,9-trimethyl-4,5-dihydro-3H-azepin[3,4-b]indol-10-yl)acetic acid Formula: C17H20N2O3 MolecularWeight: 300.3523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C3=C(N2CC(=O)O)C(=O)N(CCC3)C)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C3=C(N2CC(=O)O)C(=O)N(CCC3)C)C

InChI

InChI=1S/C17H20N2O3/c1-10-6-7-13-12-5-4-8-18(3)17(22)16(12)19(9-14(20)21)15(13)11(10)2/h6-7H,4-5,8-9H2,1-3H3,(H,20,21)