(phenylmethyl) N-(2-oxidanylidene-5-propyl-3,4-dihydro-1,4-benzodiazepin-3-yl)carbamate

Systemtic Name: (phenylmethyl) N-(2-oxidanylidene-5-propyl-3,4-dihydro-1,4-benzodiazepin-3-yl)carbamate Openeye Name: benzyl N-(2-oxo-5-propyl-3,4-dihydro-1,4-benzodiazepin-3-yl)carbamate CAS Name: N-(2-oxo-5-propyl-3,4-dihydro-1,4-benzodiazepin-3-yl)carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-(2-oxo-5-propyl-3,4-dihydro-1,4-benzodiazepin-3-yl)carbamate Traditional Name: N-(2-keto-5-propyl-3,4-dihydro-1,4-benzodiazepin-3-yl)carbamic acid benzyl ester Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C=CC=CC2=NC(=O)C(N1)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCCC1=C2C=CC=CC2=NC(=O)C(N1)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C20H21N3O3/c1-2-8-16-15-11-6-7-12-17(15)22-19(24)18(21-16)23-20(25)26-13-14-9-4-3-5-10-14/h3-7,9-12,18,21H,2,8,13H2,1H3,(H,23,25)