(phenylmethyl) N-[1-(2-cyclohexyl-2-oxidanylidene-ethyl)-9-methyl-2-oxidanylidene-5-propan-2-yl-3H-1,4-benzodiazepin-3-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-(2-cyclohexyl-2-oxidanylidene-ethyl)-9-methyl-2-oxidanylidene-5-propan-2-yl-3H-1,4-benzodiazepin-3-yl]carbamate Openeye Name: benzyl N-[1-(2-cyclohexyl-2-oxo-ethyl)-5-isopropyl-9-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]carbamate CAS Name: N-[1-(2-cyclohexyl-2-oxoethyl)-9-methyl-2-oxo-5-propan-2-yl-3H-1,4-benzodiazepin-3-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-(2-cyclohexyl-2-oxoethyl)-9-methyl-2-oxo-5-propan-2-yl-3H-1,4-benzodiazepin-3-yl]carbamate Traditional Name: N-[1-(2-cyclohexyl-2-keto-ethyl)-5-isopropyl-2-keto-9-methyl-3H-1,4-benzodiazepin-3-yl]carbamic acid benzyl ester Formula: C29H35N3O4 MolecularWeight: 489.6059

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N(C(=O)C(N=C2C(C)C)NC(=O)OCC3=CC=CC=C3)CC(=O)C4CCCCC4

Isomeric SMILES

CC1=CC=CC2=C1N(C(=O)C(N=C2C(C)C)NC(=O)OCC3=CC=CC=C3)CC(=O)C4CCCCC4

InChI

InChI=1S/C29H35N3O4/c1-19(2)25-23-16-10-11-20(3)26(23)32(17-24(33)22-14-8-5-9-15-22)28(34)27(30-25)31-29(35)36-18-21-12-6-4-7-13-21/h4,6-7,10-13,16,19,22,27H,5,8-9,14-15,17-18H2,1-3H3,(H,31,35)