N-(2,3-dimethylphenyl)-2-[2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]ethanoylamino]ethanamide

Systemtic Name: N-(2,3-dimethylphenyl)-2-[2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]ethanoylamino]ethanamide Openeye Name: N-(2,3-dimethylphenyl)-2-[[2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]acetyl]amino]acetamide CAS Name: N-(2,3-dimethylphenyl)-2-[[2-[4-(3-methoxyphenyl)-1-piperazin-1-iumyl]-1-oxoethyl]amino]acetamide IUPAC Name: N-(2,3-dimethylphenyl)-2-[[2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]acetyl]amino]acetamide Traditional Name: N-(2,3-dimethylphenyl)-2-[[2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]acetyl]amino]acetamide Formula: C23H31N4O3+ MolecularWeight: 411.51724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)CNC(=O)C[NH+]2CCN(CC2)C3=CC(=CC=C3)OC)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)CNC(=O)C[NH+]2CCN(CC2)C3=CC(=CC=C3)OC)C

InChI

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