7-(2,6-dimethoxyphenyl)-1-methyl-5-(4-methyl-3-nitro-phenyl)-3H-1,4-benzodiazepin-2-one

Systemtic Name: 7-(2,6-dimethoxyphenyl)-1-methyl-5-(4-methyl-3-nitro-phenyl)-3H-1,4-benzodiazepin-2-one Openeye Name: 7-(2,6-dimethoxyphenyl)-1-methyl-5-(4-methyl-3-nitro-phenyl)-3H-1,4-benzodiazepin-2-one CAS Name: 7-(2,6-dimethoxyphenyl)-1-methyl-5-(4-methyl-3-nitrophenyl)-3H-1,4-benzodiazepin-2-one IUPAC Name: 7-(2,6-dimethoxyphenyl)-1-methyl-5-(4-methyl-3-nitrophenyl)-3H-1,4-benzodiazepin-2-one Traditional Name: 7-(2,6-dimethoxyphenyl)-1-methyl-5-(4-methyl-3-nitro-phenyl)-3H-1,4-benzodiazepin-2-one Formula: C25H23N3O5 MolecularWeight: 445.46722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NCC(=O)N(C3=C2C=C(C=C3)C4=C(C=CC=C4OC)OC)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NCC(=O)N(C3=C2C=C(C=C3)C4=C(C=CC=C4OC)OC)C)[N+](=O)[O-]

InChI

InChI=1S/C25H23N3O5/c1-15-8-9-17(13-20(15)28(30)31)25-18-12-16(10-11-19(18)27(2)23(29)14-26-25)24-21(32-3)6-5-7-22(24)33-4/h5-13H,14H2,1-4H3