[2-(phenylmethyl)-1,3,4,5-tetrahydro-2-benzazepin-8-yl] 2-(2-oxidanylideneethyl)piperidine-1-carboxylate

Systemtic Name: [2-(phenylmethyl)-1,3,4,5-tetrahydro-2-benzazepin-8-yl] 2-(2-oxidanylideneethyl)piperidine-1-carboxylate Openeye Name: (2-benzyl-1,3,4,5-tetrahydro-2-benzazepin-8-yl) 2-(2-oxoethyl)piperidine-1-carboxylate CAS Name: 2-(2-oxoethyl)-1-piperidinecarboxylic acid [2-(phenylmethyl)-1,3,4,5-tetrahydro-2-benzazepin-8-yl] ester IUPAC Name: (2-benzyl-1,3,4,5-tetrahydro-2-benzazepin-8-yl) 2-(2-oxoethyl)piperidine-1-carboxylate Traditional Name: 2-(2-ketoethyl)piperidine-1-carboxylic acid (2-benzyl-1,3,4,5-tetrahydro-2-benzazepin-8-yl) ester Formula: C25H30N2O3 MolecularWeight: 406.5173

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)CC=O)C(=O)OC2=CC3=C(CCCN(C3)CC4=CC=CC=C4)C=C2

Isomeric SMILES

C1CCN(C(C1)CC=O)C(=O)OC2=CC3=C(CCCN(C3)CC4=CC=CC=C4)C=C2

InChI

InChI=1S/C25H30N2O3/c28-16-13-23-10-4-5-15-27(23)25(29)30-24-12-11-21-9-6-14-26(19-22(21)17-24)18-20-7-2-1-3-8-20/h1-3,7-8,11-12,16-17,23H,4-6,9-10,13-15,18-19H2