N-(2-ethylphenyl)-2-[4-[3-(2-hydroxyphenyl)propanoyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2-ethylphenyl)-2-[4-[3-(2-hydroxyphenyl)propanoyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(2-ethylphenyl)-2-[4-[3-(2-hydroxyphenyl)propanoyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-(2-ethylphenyl)-2-[4-[3-(2-hydroxyphenyl)-1-oxopropyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2-ethylphenyl)-2-[4-[3-(2-hydroxyphenyl)propanoyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2-ethylphenyl)-2-[4-[3-(2-hydroxyphenyl)propanoyl]piperazin-1-ium-1-yl]acetamide Formula: C23H30N3O3+ MolecularWeight: 396.5026

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C[NH+]2CCN(CC2)C(=O)CCC3=CC=CC=C3O

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C[NH+]2CCN(CC2)C(=O)CCC3=CC=CC=C3O

InChI

InChI=1S/C23H29N3O3/c1-2-18-7-3-5-9-20(18)24-22(28)17-25-13-15-26(16-14-25)23(29)12-11-19-8-4-6-10-21(19)27/h3-10,27H,2,11-17H2,1H3,(H,24,28)/p+1