2-(7-azanyl-3-oxidanylidene-2-phenethyl-4,5-dihydro-1H-2-benzazepin-4-yl)ethanoic acid

Systemtic Name: 2-(7-azanyl-3-oxidanylidene-2-phenethyl-4,5-dihydro-1H-2-benzazepin-4-yl)ethanoic acid Openeye Name: 2-(7-amino-3-oxo-2-phenethyl-4,5-dihydro-1H-2-benzazepin-4-yl)acetic acid CAS Name: 2-(7-amino-3-oxo-2-phenethyl-4,5-dihydro-1H-2-benzazepin-4-yl)acetic acid IUPAC Name: 2-(7-amino-3-oxo-2-phenethyl-4,5-dihydro-1H-2-benzazepin-4-yl)acetic acid Traditional Name: 2-(7-amino-3-keto-2-phenethyl-4,5-dihydro-1H-2-benzazepin-4-yl)acetic acid Formula: C20H22N2O3 MolecularWeight: 338.40028

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N(CC2=C1C=C(C=C2)N)CCC3=CC=CC=C3)CC(=O)O

Isomeric SMILES

C1C(C(=O)N(CC2=C1C=C(C=C2)N)CCC3=CC=CC=C3)CC(=O)O

InChI

InChI=1S/C20H22N2O3/c21-18-7-6-15-13-22(9-8-14-4-2-1-3-5-14)20(25)17(12-19(23)24)10-16(15)11-18/h1-7,11,17H,8-10,12-13,21H2,(H,23,24)