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

Systemtic Name: (phenylmethyl) N-[(3R)-5-cycloheptyl-1-(2-methylpropyl)-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl]carbamate Openeye Name: benzyl N-[(3R)-5-cycloheptyl-1-isobutyl-2-oxo-3H-1,4-benzodiazepin-3-yl]carbamate CAS Name: N-[(3R)-5-cycloheptyl-1-(2-methylpropyl)-2-oxo-3H-1,4-benzodiazepin-3-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(3R)-5-cycloheptyl-1-(2-methylpropyl)-2-oxo-3H-1,4-benzodiazepin-3-yl]carbamate Traditional Name: N-[(3R)-5-cycloheptyl-1-isobutyl-2-keto-3H-1,4-benzodiazepin-3-yl]carbamic acid benzyl ester Formula: C28H35N3O3 MolecularWeight: 461.5958

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)OCC3=CC=CC=C3)C4CCCCCC4

Isomeric SMILES

CC(C)CN1C2=CC=CC=C2C(=N[C@H](C1=O)NC(=O)OCC3=CC=CC=C3)C4CCCCCC4

InChI

InChI=1S/C28H35N3O3/c1-20(2)18-31-24-17-11-10-16-23(24)25(22-14-8-3-4-9-15-22)29-26(27(31)32)30-28(33)34-19-21-12-6-5-7-13-21/h5-7,10-13,16-17,20,22,26H,3-4,8-9,14-15,18-19H2,1-2H3,(H,30,33)/t26-/m0/s1