(2R)-N-(4-acetamidophenyl)-2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]propanamide

Systemtic Name: (2R)-N-(4-acetamidophenyl)-2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]propanamide Openeye Name: (2R)-N-(4-acetamidophenyl)-2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]propanamide CAS Name: (2R)-N-(4-acetamidophenyl)-2-[4-(2-ethoxyphenyl)-1-piperazin-1-iumyl]propanamide IUPAC Name: (2R)-N-(4-acetamidophenyl)-2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]propanamide Traditional Name: (2R)-N-(4-acetamidophenyl)-2-(4-o-phenetylpiperazin-1-ium-1-yl)propionamide Formula: C23H31N4O3+ MolecularWeight: 411.51724

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC1=CC=CC=C1N2CC[NH+](CC2)[C@H](C)C(=O)NC3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C23H30N4O3/c1-4-30-22-8-6-5-7-21(22)27-15-13-26(14-16-27)17(2)23(29)25-20-11-9-19(10-12-20)24-18(3)28/h5-12,17H,4,13-16H2,1-3H3,(H,24,28)(H,25,29)/p+1/t17-/m1/s1