(phenylmethyl) N-(9-methyl-2-oxidanylidene-5-propan-2-yl-3,4-dihydro-1,4-benzodiazepin-3-yl)carbamate

Systemtic Name: (phenylmethyl) N-(9-methyl-2-oxidanylidene-5-propan-2-yl-3,4-dihydro-1,4-benzodiazepin-3-yl)carbamate Openeye Name: benzyl N-(5-isopropyl-9-methyl-2-oxo-3,4-dihydro-1,4-benzodiazepin-3-yl)carbamate CAS Name: N-(9-methyl-2-oxo-5-propan-2-yl-3,4-dihydro-1,4-benzodiazepin-3-yl)carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-(9-methyl-2-oxo-5-propan-2-yl-3,4-dihydro-1,4-benzodiazepin-3-yl)carbamate Traditional Name: N-(5-isopropyl-2-keto-9-methyl-3,4-dihydro-1,4-benzodiazepin-3-yl)carbamic acid benzyl ester Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C(NC(C(=O)N=C12)NC(=O)OCC3=CC=CC=C3)C(C)C

Isomeric SMILES

CC1=CC=CC2=C(NC(C(=O)N=C12)NC(=O)OCC3=CC=CC=C3)C(C)C

InChI

InChI=1S/C21H23N3O3/c1-13(2)17-16-11-7-8-14(3)18(16)23-20(25)19(22-17)24-21(26)27-12-15-9-5-4-6-10-15/h4-11,13,19,22H,12H2,1-3H3,(H,24,26)