tert-butyl 1-(phenylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-carboxylate

Systemtic Name: tert-butyl 1-(phenylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-carboxylate Openeye Name: tert-butyl 1-benzyl-3,5-dihydro-2H-1,4-benzodiazepine-4-carboxylate CAS Name: 1-(phenylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-benzyl-3,5-dihydro-2H-1,4-benzodiazepine-4-carboxylate Traditional Name: 1-benzyl-3,5-dihydro-2H-1,4-benzodiazepine-4-carboxylic acid tert-butyl ester Formula: C21H26N2O2 MolecularWeight: 338.44334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(C2=CC=CC=C2C1)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(C2=CC=CC=C2C1)CC3=CC=CC=C3

InChI

InChI=1S/C21H26N2O2/c1-21(2,3)25-20(24)23-14-13-22(15-17-9-5-4-6-10-17)19-12-8-7-11-18(19)16-23/h4-12H,13-16H2,1-3H3