N-(2-ethylphenyl)-2-[2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]ethanoylamino]ethanamide

Systemtic Name: N-(2-ethylphenyl)-2-[2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]ethanoylamino]ethanamide Openeye Name: N-(2-ethylphenyl)-2-[[2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]acetyl]amino]acetamide CAS Name: N-(2-ethylphenyl)-2-[[2-[4-(4-methoxyphenyl)-1-piperazin-1-iumyl]-1-oxoethyl]amino]acetamide IUPAC Name: N-(2-ethylphenyl)-2-[[2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]acetyl]amino]acetamide Traditional Name: N-(2-ethylphenyl)-2-[[2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]acetyl]amino]acetamide Formula: C23H31N4O3+ MolecularWeight: 411.51724

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30N4O3/c1-3-18-6-4-5-7-21(18)25-22(28)16-24-23(29)17-26-12-14-27(15-13-26)19-8-10-20(30-2)11-9-19/h4-11H,3,12-17H2,1-2H3,(H,24,29)(H,25,28)/p+1