N-[2-[2-methoxy-5-[[4-(2-methylphenyl)piperazin-1-ium-1-yl]methyl]phenoxy]ethyl]-4-methyl-benzamide

Systemtic Name: N-[2-[2-methoxy-5-[[4-(2-methylphenyl)piperazin-1-ium-1-yl]methyl]phenoxy]ethyl]-4-methyl-benzamide Openeye Name: N-[2-[2-methoxy-5-[[4-(o-tolyl)piperazin-1-ium-1-yl]methyl]phenoxy]ethyl]-4-methyl-benzamide CAS Name: N-[2-[2-methoxy-5-[[4-(2-methylphenyl)-1-piperazin-1-iumyl]methyl]phenoxy]ethyl]-4-methylbenzamide IUPAC Name: N-[2-[2-methoxy-5-[[4-(2-methylphenyl)piperazin-1-ium-1-yl]methyl]phenoxy]ethyl]-4-methylbenzamide Traditional Name: N-[2-[2-methoxy-5-[[4-(o-tolyl)piperazin-1-ium-1-yl]methyl]phenoxy]ethyl]-4-methyl-benzamide Formula: C29H36N3O3+ MolecularWeight: 474.61444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NCCOC2=C(C=CC(=C2)C[NH+]3CCN(CC3)C4=CC=CC=C4C)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NCCOC2=C(C=CC(=C2)C[NH+]3CCN(CC3)C4=CC=CC=C4C)OC

InChI

InChI=1S/C29H35N3O3/c1-22-8-11-25(12-9-22)29(33)30-14-19-35-28-20-24(10-13-27(28)34-3)21-31-15-17-32(18-16-31)26-7-5-4-6-23(26)2/h4-13,20H,14-19,21H2,1-3H3,(H,30,33)/p+1