N-[2-(4-dimethylaminophenyl)-2-(4-methylpiperazin-1-yl)ethyl]-4-methyl-3-nitro-benzamide

Systemtic Name: N-[2-(4-dimethylaminophenyl)-2-(4-methylpiperazin-1-yl)ethyl]-4-methyl-3-nitro-benzamide Openeye Name: N-[2-(4-dimethylaminophenyl)-2-(4-methylpiperazin-1-yl)ethyl]-4-methyl-3-nitro-benzamide CAS Name: N-[2-(4-dimethylaminophenyl)-2-(4-methyl-1-piperazinyl)ethyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[2-(4-dimethylaminophenyl)-2-(4-methylpiperazin-1-yl)ethyl]-4-methyl-3-nitrobenzamide Traditional Name: N-[2-(4-dimethylaminophenyl)-2-(4-methylpiperazino)ethyl]-4-methyl-3-nitro-benzamide Formula: C23H31N5O3 MolecularWeight: 425.52394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC(C2=CC=C(C=C2)N(C)C)N3CCN(CC3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC(C2=CC=C(C=C2)N(C)C)N3CCN(CC3)C)[N+](=O)[O-]

InChI

InChI=1S/C23H31N5O3/c1-17-5-6-19(15-21(17)28(30)31)23(29)24-16-22(27-13-11-26(4)12-14-27)18-7-9-20(10-8-18)25(2)3/h5-10,15,22H,11-14,16H2,1-4H3,(H,24,29)