N'-(4-ethylphenyl)-N-[2-[4-(3-methylphenyl)carbonylpiperazin-1-ium-1-yl]ethyl]ethanediamide

Systemtic Name: N'-(4-ethylphenyl)-N-[2-[4-(3-methylphenyl)carbonylpiperazin-1-ium-1-yl]ethyl]ethanediamide Openeye Name: N'-(4-ethylphenyl)-N-[2-[4-(3-methylbenzoyl)piperazin-1-ium-1-yl]ethyl]oxamide CAS Name: N'-(4-ethylphenyl)-N-[2-[4-[(3-methylphenyl)-oxomethyl]-1-piperazin-1-iumyl]ethyl]oxamide IUPAC Name: N'-(4-ethylphenyl)-N-[2-[4-(3-methylbenzoyl)piperazin-1-ium-1-yl]ethyl]oxamide Traditional Name: N'-(4-ethylphenyl)-N-[2-(4-m-toluoylpiperazin-1-ium-1-yl)ethyl]oxamide Formula: C24H31N4O3+ MolecularWeight: 423.52794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C(=O)NCC[NH+]2CCN(CC2)C(=O)C3=CC(=CC=C3)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C(=O)NCC[NH+]2CCN(CC2)C(=O)C3=CC(=CC=C3)C

InChI

InChI=1S/C24H30N4O3/c1-3-19-7-9-21(10-8-19)26-23(30)22(29)25-11-12-27-13-15-28(16-14-27)24(31)20-6-4-5-18(2)17-20/h4-10,17H,3,11-16H2,1-2H3,(H,25,29)(H,26,30)/p+1