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

Systemtic Name: (4-nitrophenyl) N-[(3R)-5-cycloheptyl-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl]carbamate Openeye Name: (4-nitrophenyl) N-[(3R)-5-cycloheptyl-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]carbamate CAS Name: N-[(3R)-5-cycloheptyl-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]carbamic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) N-[(3R)-5-cycloheptyl-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]carbamate Traditional Name: N-[(3R)-5-cycloheptyl-2-keto-1-methyl-3H-1,4-benzodiazepin-3-yl]carbamic acid (4-nitrophenyl) ester Formula: C24H26N4O5 MolecularWeight: 450.48704

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)OC3=CC=C(C=C3)[N+](=O)[O-])C4CCCCCC4

Isomeric SMILES

CN1C2=CC=CC=C2C(=N[C@H](C1=O)NC(=O)OC3=CC=C(C=C3)[N+](=O)[O-])C4CCCCCC4

InChI

InChI=1S/C24H26N4O5/c1-27-20-11-7-6-10-19(20)21(16-8-4-2-3-5-9-16)25-22(23(27)29)26-24(30)33-18-14-12-17(13-15-18)28(31)32/h6-7,10-16,22H,2-5,8-9H2,1H3,(H,26,30)/t22-/m0/s1