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

Systemtic Name: (phenylmethyl) N-(5-cyclohexyl-2-oxidanylidene-1-propyl-3H-1,4-benzodiazepin-3-yl)carbamate Openeye Name: benzyl N-(5-cyclohexyl-2-oxo-1-propyl-3H-1,4-benzodiazepin-3-yl)carbamate CAS Name: N-(5-cyclohexyl-2-oxo-1-propyl-3H-1,4-benzodiazepin-3-yl)carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-(5-cyclohexyl-2-oxo-1-propyl-3H-1,4-benzodiazepin-3-yl)carbamate Traditional Name: N-(5-cyclohexyl-2-keto-1-propyl-3H-1,4-benzodiazepin-3-yl)carbamic acid benzyl ester Formula: C26H31N3O3 MolecularWeight: 433.54264

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)OCC3=CC=CC=C3)C4CCCCC4

Isomeric SMILES

CCCN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)OCC3=CC=CC=C3)C4CCCCC4

InChI

InChI=1S/C26H31N3O3/c1-2-17-29-22-16-10-9-15-21(22)23(20-13-7-4-8-14-20)27-24(25(29)30)28-26(31)32-18-19-11-5-3-6-12-19/h3,5-6,9-12,15-16,20,24H,2,4,7-8,13-14,17-18H2,1H3,(H,28,31)