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

Systemtic Name: N-[2-[4-(4-methoxyphenyl)carbonylpiperazin-1-ium-1-yl]ethyl]-N'-(4-methylphenyl)ethanediamide Openeye Name: N-[2-[4-(4-methoxybenzoyl)piperazin-1-ium-1-yl]ethyl]-N'-(p-tolyl)oxamide CAS Name: N-[2-[4-[(4-methoxyphenyl)-oxomethyl]-1-piperazin-1-iumyl]ethyl]-N'-(4-methylphenyl)oxamide IUPAC Name: N-[2-[4-(4-methoxybenzoyl)piperazin-1-ium-1-yl]ethyl]-N'-(4-methylphenyl)oxamide Traditional Name: N-[2-(4-p-anisoylpiperazin-1-ium-1-yl)ethyl]-N'-(p-tolyl)oxamide Formula: C23H29N4O4+ MolecularWeight: 425.50076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(=O)NCC[NH+]2CCN(CC2)C(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C(=O)NCC[NH+]2CCN(CC2)C(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C23H28N4O4/c1-17-3-7-19(8-4-17)25-22(29)21(28)24-11-12-26-13-15-27(16-14-26)23(30)18-5-9-20(31-2)10-6-18/h3-10H,11-16H2,1-2H3,(H,24,28)(H,25,29)/p+1