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

Systemtic Name: 2-(1-oxidanylidene-3,4,5,10-tetrahydro-2H-azepino[3,4-b]indol-9-yl)ethanoic acid Openeye Name: 2-(1-oxo-3,4,5,10-tetrahydro-2H-azepino[3,4-b]indol-9-yl)acetic acid CAS Name: 2-(1-oxo-3,4,5,10-tetrahydro-2H-azepino[3,4-b]indol-9-yl)acetic acid IUPAC Name: 2-(1-oxo-3,4,5,10-tetrahydro-2H-azepino[3,4-b]indol-9-yl)acetic acid Traditional Name: 2-(1-keto-3,4,5,10-tetrahydro-2H-azepin[3,4-b]indol-9-yl)acetic acid Formula: C14H14N2O3 MolecularWeight: 258.27256

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(=O)NC1)NC3=C2C=CC=C3CC(=O)O

Isomeric SMILES

C1CC2=C(C(=O)NC1)NC3=C2C=CC=C3CC(=O)O

InChI

InChI=1S/C14H14N2O3/c17-11(18)7-8-3-1-4-9-10-5-2-6-15-14(19)13(10)16-12(8)9/h1,3-4,16H,2,5-7H2,(H,15,19)(H,17,18)