2-(7-methoxy-2-methyl-1-oxidanylidene-4,5-dihydro-3H-azepino[3,4-b]indol-10-yl)ethanoic acid

Systemtic Name: 2-(7-methoxy-2-methyl-1-oxidanylidene-4,5-dihydro-3H-azepino[3,4-b]indol-10-yl)ethanoic acid Openeye Name: 2-(7-methoxy-2-methyl-1-oxo-4,5-dihydro-3H-azepino[3,4-b]indol-10-yl)acetic acid CAS Name: 2-(7-methoxy-2-methyl-1-oxo-4,5-dihydro-3H-azepino[3,4-b]indol-10-yl)acetic acid IUPAC Name: 2-(7-methoxy-2-methyl-1-oxo-4,5-dihydro-3H-azepino[3,4-b]indol-10-yl)acetic acid Traditional Name: 2-(1-keto-7-methoxy-2-methyl-4,5-dihydro-3H-azepin[3,4-b]indol-10-yl)acetic acid Formula: C16H18N2O4 MolecularWeight: 302.32512

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC2=C(C1=O)N(C3=C2C=C(C=C3)OC)CC(=O)O

Isomeric SMILES

CN1CCCC2=C(C1=O)N(C3=C2C=C(C=C3)OC)CC(=O)O

InChI

InChI=1S/C16H18N2O4/c1-17-7-3-4-11-12-8-10(22-2)5-6-13(12)18(9-14(19)20)15(11)16(17)21/h5-6,8H,3-4,7,9H2,1-2H3,(H,19,20)