N-(2-methoxyphenyl)-2-[4-[(4-methylphenyl)methyl]piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-(2-methoxyphenyl)-2-[4-[(4-methylphenyl)methyl]piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-(2-methoxyphenyl)-2-[4-(p-tolylmethyl)piperazine-1,4-diium-1-yl]acetamide CAS Name: N-(2-methoxyphenyl)-2-[4-[(4-methylphenyl)methyl]-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-(2-methoxyphenyl)-2-[4-[(4-methylphenyl)methyl]piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-(2-methoxyphenyl)-2-[4-(4-methylbenzyl)piperazine-1,4-diium-1-yl]acetamide Formula: C21H29N3O2+2 MolecularWeight: 355.47386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH+]2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3OC

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+]2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3OC

InChI

InChI=1S/C21H27N3O2/c1-17-7-9-18(10-8-17)15-23-11-13-24(14-12-23)16-21(25)22-19-5-3-4-6-20(19)26-2/h3-10H,11-16H2,1-2H3,(H,22,25)/p+2