(phenylmethyl) N-[(3R)-5-cyclohexyl-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(3R)-5-cyclohexyl-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl]carbamate Openeye Name: benzyl N-[(3R)-5-cyclohexyl-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]carbamate CAS Name: N-[(3R)-5-cyclohexyl-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(3R)-5-cyclohexyl-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]carbamate Traditional Name: N-[(3R)-5-cyclohexyl-2-keto-1-methyl-3H-1,4-benzodiazepin-3-yl]carbamic acid benzyl ester Formula: C24H27N3O3 MolecularWeight: 405.48948

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)OCC3=CC=CC=C3)C4CCCCC4

Isomeric SMILES

CN1C2=CC=CC=C2C(=N[C@H](C1=O)NC(=O)OCC3=CC=CC=C3)C4CCCCC4

InChI

InChI=1S/C24H27N3O3/c1-27-20-15-9-8-14-19(20)21(18-12-6-3-7-13-18)25-22(23(27)28)26-24(29)30-16-17-10-4-2-5-11-17/h2,4-5,8-11,14-15,18,22H,3,6-7,12-13,16H2,1H3,(H,26,29)/t22-/m0/s1