1-[4-ethoxy-3-[[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]methyl]phenyl]ethanone

Systemtic Name: 1-[4-ethoxy-3-[[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]methyl]phenyl]ethanone Openeye Name: 1-[4-ethoxy-3-[[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]methyl]phenyl]ethanone CAS Name: 1-[4-ethoxy-3-[[4-(4-hydroxyphenyl)-1-piperazin-1-iumyl]methyl]phenyl]ethanone IUPAC Name: 1-[4-ethoxy-3-[[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]methyl]phenyl]ethanone Traditional Name: 1-[4-ethoxy-3-[[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]methyl]phenyl]ethanone Formula: C21H27N2O3+ MolecularWeight: 355.45068

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)C[NH+]2CCN(CC2)C3=CC=C(C=C3)O

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)C[NH+]2CCN(CC2)C3=CC=C(C=C3)O

InChI

InChI=1S/C21H26N2O3/c1-3-26-21-9-4-17(16(2)24)14-18(21)15-22-10-12-23(13-11-22)19-5-7-20(25)8-6-19/h4-9,14,25H,3,10-13,15H2,1-2H3/p+1