tert-butyl (2R)-2-methyl-3-oxidanylidene-4-[(1R)-2-oxidanyl-1-phenyl-ethyl]-2,5-dihydro-1,4-benzodiazepine-1-carboxylate

Systemtic Name: tert-butyl (2R)-2-methyl-3-oxidanylidene-4-[(1R)-2-oxidanyl-1-phenyl-ethyl]-2,5-dihydro-1,4-benzodiazepine-1-carboxylate Openeye Name: tert-butyl (2R)-4-[(1R)-2-hydroxy-1-phenyl-ethyl]-2-methyl-3-oxo-2,5-dihydro-1,4-benzodiazepine-1-carboxylate CAS Name: (2R)-4-[(1R)-2-hydroxy-1-phenylethyl]-2-methyl-3-oxo-2,5-dihydro-1,4-benzodiazepine-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R)-4-[(1R)-2-hydroxy-1-phenylethyl]-2-methyl-3-oxo-2,5-dihydro-1,4-benzodiazepine-1-carboxylate Traditional Name: (2R)-4-[(1R)-2-hydroxy-1-phenyl-ethyl]-3-keto-2-methyl-2,5-dihydro-1,4-benzodiazepine-1-carboxylic acid tert-butyl ester Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CC2=CC=CC=C2N1C(=O)OC(C)(C)C)C(CO)C3=CC=CC=C3

Isomeric SMILES

C[C@@H]1C(=O)N(CC2=CC=CC=C2N1C(=O)OC(C)(C)C)[C@@H](CO)C3=CC=CC=C3

InChI

InChI=1S/C23H28N2O4/c1-16-21(27)24(20(15-26)17-10-6-5-7-11-17)14-18-12-8-9-13-19(18)25(16)22(28)29-23(2,3)4/h5-13,16,20,26H,14-15H2,1-4H3/t16-,20+/m1/s1