tert-butyl 1-(2-azanyl-2-oxidanylidene-ethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-carboxylate

Systemtic Name: tert-butyl 1-(2-azanyl-2-oxidanylidene-ethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-carboxylate Openeye Name: tert-butyl 1-(2-amino-2-oxo-ethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-carboxylate CAS Name: 1-(2-amino-2-oxoethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-(2-amino-2-oxoethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-carboxylate Traditional Name: 1-(2-amino-2-keto-ethyl)-3,5-dihydro-2H-1,4-benzodiazepine-4-carboxylic acid tert-butyl ester Formula: C16H23N3O3 MolecularWeight: 305.37212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(C2=CC=CC=C2C1)CC(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(C2=CC=CC=C2C1)CC(=O)N

InChI

InChI=1S/C16H23N3O3/c1-16(2,3)22-15(21)19-9-8-18(11-14(17)20)13-7-5-4-6-12(13)10-19/h4-7H,8-11H2,1-3H3,(H2,17,20)