3,4,5-trimethoxy-N-[2-[4-(3-methylphenyl)piperazin-1-yl]ethyl]-2-nitro-benzamide

Systemtic Name: 3,4,5-trimethoxy-N-[2-[4-(3-methylphenyl)piperazin-1-yl]ethyl]-2-nitro-benzamide Openeye Name: 3,4,5-trimethoxy-N-[2-[4-(m-tolyl)piperazin-1-yl]ethyl]-2-nitro-benzamide CAS Name: 3,4,5-trimethoxy-N-[2-[4-(3-methylphenyl)-1-piperazinyl]ethyl]-2-nitrobenzamide IUPAC Name: 3,4,5-trimethoxy-N-[2-[4-(3-methylphenyl)piperazin-1-yl]ethyl]-2-nitrobenzamide Traditional Name: 3,4,5-trimethoxy-N-[2-[4-(m-tolyl)piperazino]ethyl]-2-nitro-benzamide Formula: C23H30N4O6 MolecularWeight: 458.5075

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CCNC(=O)C3=CC(=C(C(=C3[N+](=O)[O-])OC)OC)OC

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CCNC(=O)C3=CC(=C(C(=C3[N+](=O)[O-])OC)OC)OC

InChI

InChI=1S/C23H30N4O6/c1-16-6-5-7-17(14-16)26-12-10-25(11-13-26)9-8-24-23(28)18-15-19(31-2)21(32-3)22(33-4)20(18)27(29)30/h5-7,14-15H,8-13H2,1-4H3,(H,24,28)