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

Systemtic Name: N-(3,4-dimethoxyphenyl)-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(3,4-dimethoxyphenyl)-2-[4-(o-tolyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(3,4-dimethoxyphenyl)-2-[4-(2-methylphenyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(3,4-dimethoxyphenyl)-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(3,4-dimethoxyphenyl)-2-[4-(o-tolyl)piperazin-1-ium-1-yl]acetamide Formula: C21H28N3O3+ MolecularWeight: 370.46532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CC[NH+](CC2)CC(=O)NC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC=CC=C1N2CC[NH+](CC2)CC(=O)NC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H27N3O3/c1-16-6-4-5-7-18(16)24-12-10-23(11-13-24)15-21(25)22-17-8-9-19(26-2)20(14-17)27-3/h4-9,14H,10-13,15H2,1-3H3,(H,22,25)/p+1