2-(4-oxidanylidene-1,2,3,5-tetrahydro-3-benzazepin-5-yl)ethanoate

Systemtic Name: 2-(4-oxidanylidene-1,2,3,5-tetrahydro-3-benzazepin-5-yl)ethanoate Openeye Name: 2-(4-oxo-1,2,3,5-tetrahydro-3-benzazepin-5-yl)acetate CAS Name: 2-(4-oxo-1,2,3,5-tetrahydro-3-benzazepin-5-yl)acetate IUPAC Name: 2-(4-oxo-1,2,3,5-tetrahydro-3-benzazepin-5-yl)acetate Traditional Name: 2-(4-keto-1,2,3,5-tetrahydro-3-benzazepin-5-yl)acetate Formula: C12H12NO3- MolecularWeight: 218.22858

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=O)C(C2=CC=CC=C21)CC(=O)[O-]

Isomeric SMILES

C1CNC(=O)C(C2=CC=CC=C21)CC(=O)[O-]

InChI

InChI=1S/C12H13NO3/c14-11(15)7-10-9-4-2-1-3-8(9)5-6-13-12(10)16/h1-4,10H,5-7H2,(H,13,16)(H,14,15)/p-1