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

Systemtic Name: N-(3,4-diethoxyphenyl)-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(3,4-diethoxyphenyl)-2-[4-(o-tolyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(3,4-diethoxyphenyl)-2-[4-(2-methylphenyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(3,4-diethoxyphenyl)-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(3,4-diethoxyphenyl)-2-[4-(o-tolyl)piperazin-1-ium-1-yl]acetamide Formula: C23H32N3O3+ MolecularWeight: 398.51848

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3C)OCC

InChI

InChI=1S/C23H31N3O3/c1-4-28-21-11-10-19(16-22(21)29-5-2)24-23(27)17-25-12-14-26(15-13-25)20-9-7-6-8-18(20)3/h6-11,16H,4-5,12-15,17H2,1-3H3,(H,24,27)/p+1