N-[(3,4-dimethoxyphenyl)methyl]-N-ethyl-2-[4-[(2-methylphenyl)methyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-N-ethyl-2-[4-[(2-methylphenyl)methyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-N-ethyl-2-[4-(o-tolylmethyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-N-ethyl-2-[4-[(2-methylphenyl)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-N-ethyl-2-[4-[(2-methylphenyl)methyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-ethyl-2-[4-(2-methylbenzyl)piperazin-1-ium-1-yl]-N-veratryl-acetamide Formula: C25H36N3O3+ MolecularWeight: 426.57164

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=C(C=C1)OC)OC)C(=O)C[NH+]2CCN(CC2)CC3=CC=CC=C3C

Isomeric SMILES

CCN(CC1=CC(=C(C=C1)OC)OC)C(=O)C[NH+]2CCN(CC2)CC3=CC=CC=C3C

InChI

InChI=1S/C25H35N3O3/c1-5-28(17-21-10-11-23(30-3)24(16-21)31-4)25(29)19-27-14-12-26(13-15-27)18-22-9-7-6-8-20(22)2/h6-11,16H,5,12-15,17-19H2,1-4H3/p+1