N-(4-ethanoylphenyl)-3-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]propanamide

Systemtic Name: N-(4-ethanoylphenyl)-3-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]propanamide Openeye Name: N-(4-acetylphenyl)-3-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]propanamide CAS Name: N-(4-acetylphenyl)-3-[4-(2-ethoxyphenyl)-1-piperazin-1-iumyl]propanamide IUPAC Name: N-(4-acetylphenyl)-3-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]propanamide Traditional Name: N-(4-acetylphenyl)-3-(4-o-phenetylpiperazin-1-ium-1-yl)propionamide Formula: C23H30N3O3+ MolecularWeight: 396.5026

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CC[NH+](CC2)CCC(=O)NC3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CCOC1=CC=CC=C1N2CC[NH+](CC2)CCC(=O)NC3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C23H29N3O3/c1-3-29-22-7-5-4-6-21(22)26-16-14-25(15-17-26)13-12-23(28)24-20-10-8-19(9-11-20)18(2)27/h4-11H,3,12-17H2,1-2H3,(H,24,28)/p+1