[(7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino] N-(2,6-dimethylphenyl)carbamate

Systemtic Name: [(7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino] N-(2,6-dimethylphenyl)carbamate Openeye Name: [(7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino] N-(2,6-dimethylphenyl)carbamate CAS Name: N-(2,6-dimethylphenyl)carbamic acid [(7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino] ester IUPAC Name: [(7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino] N-(2,6-dimethylphenyl)carbamate Traditional Name: N-(2,6-dimethylphenyl)carbamic acid [(7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino] ester Formula: C24H21N5O4 MolecularWeight: 443.45464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)ONC2=NC3=C(C=C(C=C3)[N+](=O)[O-])C(=NC2)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)ONC2=NC3=C(C=C(C=C3)[N+](=O)[O-])C(=NC2)C4=CC=CC=C4

InChI

InChI=1S/C24H21N5O4/c1-15-7-6-8-16(2)22(15)27-24(30)33-28-21-14-25-23(17-9-4-3-5-10-17)19-13-18(29(31)32)11-12-20(19)26-21/h3-13H,14H2,1-2H3,(H,26,28)(H,27,30)