2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-[(3-methoxyphenyl)methyl]ethanamide

Systemtic Name: 2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-[(3-methoxyphenyl)methyl]ethanamide Openeye Name: 2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-[(3-methoxyphenyl)methyl]acetamide CAS Name: 2-[4-(4-hydroxyphenyl)-1-piperazin-1-iumyl]-N-[(3-methoxyphenyl)methyl]acetamide IUPAC Name: 2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-[(3-methoxyphenyl)methyl]acetamide Traditional Name: 2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-m-anisyl-acetamide Formula: C20H26N3O3+ MolecularWeight: 356.43874

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNC(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)O

Isomeric SMILES

COC1=CC=CC(=C1)CNC(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)O

InChI

InChI=1S/C20H25N3O3/c1-26-19-4-2-3-16(13-19)14-21-20(25)15-22-9-11-23(12-10-22)17-5-7-18(24)8-6-17/h2-8,13,24H,9-12,14-15H2,1H3,(H,21,25)/p+1