tert-butyl 3-[(7-methoxy-1-methyl-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-8-yl)methylamino]-2-phenyl-piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[(7-methoxy-1-methyl-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-8-yl)methylamino]-2-phenyl-piperidine-1-carboxylate Openeye Name: tert-butyl 3-[(7-methoxy-1-methyl-2-oxo-4,5-dihydro-3H-1-benzazepin-8-yl)methylamino]-2-phenyl-piperidine-1-carboxylate CAS Name: 3-[(7-methoxy-1-methyl-2-oxo-4,5-dihydro-3H-1-benzazepin-8-yl)methylamino]-2-phenyl-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(7-methoxy-1-methyl-2-oxo-4,5-dihydro-3H-1-benzazepin-8-yl)methylamino]-2-phenylpiperidine-1-carboxylate Traditional Name: 3-[(2-keto-7-methoxy-1-methyl-4,5-dihydro-3H-1-benzazepin-8-yl)methylamino]-2-phenyl-piperidine-1-carboxylic acid tert-butyl ester Formula: C29H39N3O4 MolecularWeight: 493.63766

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1C2=CC=CC=C2)NCC3=C(C=C4CCCC(=O)N(C4=C3)C)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1C2=CC=CC=C2)NCC3=C(C=C4CCCC(=O)N(C4=C3)C)OC

InChI

InChI=1S/C29H39N3O4/c1-29(2,3)36-28(34)32-16-10-14-23(27(32)20-11-7-6-8-12-20)30-19-22-17-24-21(18-25(22)35-5)13-9-15-26(33)31(24)4/h6-8,11-12,17-18,23,27,30H,9-10,13-16,19H2,1-5H3