N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-3-[(2-nitrophenyl)amino]propanamide

Systemtic Name: N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-3-[(2-nitrophenyl)amino]propanamide Openeye Name: N-[3-[4-(m-tolyl)piperazin-1-yl]propyl]-3-(2-nitroanilino)propanamide CAS Name: N-[3-[4-(3-methylphenyl)-1-piperazinyl]propyl]-3-(2-nitroanilino)propanamide IUPAC Name: N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-3-(2-nitroanilino)propanamide Traditional Name: N-[3-[4-(m-tolyl)piperazino]propyl]-3-(2-nitroanilino)propionamide Formula: C23H31N5O3 MolecularWeight: 425.52394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CCCNC(=O)CCNC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CCCNC(=O)CCNC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C23H31N5O3/c1-19-6-4-7-20(18-19)27-16-14-26(15-17-27)13-5-11-25-23(29)10-12-24-21-8-2-3-9-22(21)28(30)31/h2-4,6-9,18,24H,5,10-17H2,1H3,(H,25,29)