(11-cyano-5,6-dihydrobenzo[b][1]benzazepin-5-yl) benzoate

Systemtic Name: (11-cyano-5,6-dihydrobenzo[b][1]benzazepin-5-yl) benzoate Openeye Name: (11-cyano-5,6-dihydrobenzo[b][1]benzazepin-5-yl) benzoate CAS Name: benzoic acid (11-cyano-5,6-dihydrobenzo[b][1]benzazepin-5-yl) ester IUPAC Name: (11-cyano-5,6-dihydrobenzo[b][1]benzazepin-5-yl) benzoate Traditional Name: benzoic acid (11-cyano-5,6-dihydrobenzo[b][1]benzazepin-5-yl) ester Formula: C22H16N2O2 MolecularWeight: 340.37464

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=CC=CC=C2N(C3=CC=CC=C31)C#N)OC(=O)C4=CC=CC=C4

Isomeric SMILES

C1C(C2=CC=CC=C2N(C3=CC=CC=C31)C#N)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H16N2O2/c23-15-24-19-12-6-4-10-17(19)14-21(18-11-5-7-13-20(18)24)26-22(25)16-8-2-1-3-9-16/h1-13,21H,14H2