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

Systemtic Name: 2-[4-[2-(3,4-dimethoxyphenyl)ethanoyl]piperazin-1-ium-1-yl]-N-(2-ethylphenyl)ethanamide Openeye Name: 2-[4-[2-(3,4-dimethoxyphenyl)acetyl]piperazin-1-ium-1-yl]-N-(2-ethylphenyl)acetamide CAS Name: 2-[4-[2-(3,4-dimethoxyphenyl)-1-oxoethyl]-1-piperazin-1-iumyl]-N-(2-ethylphenyl)acetamide IUPAC Name: 2-[4-[2-(3,4-dimethoxyphenyl)acetyl]piperazin-1-ium-1-yl]-N-(2-ethylphenyl)acetamide Traditional Name: N-(2-ethylphenyl)-2-(4-homoveratroylpiperazin-1-ium-1-yl)acetamide Formula: C24H32N3O4+ MolecularWeight: 426.52858

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C[NH+]2CCN(CC2)C(=O)CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C[NH+]2CCN(CC2)C(=O)CC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C24H31N3O4/c1-4-19-7-5-6-8-20(19)25-23(28)17-26-11-13-27(14-12-26)24(29)16-18-9-10-21(30-2)22(15-18)31-3/h5-10,15H,4,11-14,16-17H2,1-3H3,(H,25,28)/p+1