2-ethoxy-4-[[4-(2-methylphenyl)piperazin-1-ium-1-yl]methyl]phenol

Systemtic Name: 2-ethoxy-4-[[4-(2-methylphenyl)piperazin-1-ium-1-yl]methyl]phenol Openeye Name: 2-ethoxy-4-[[4-(o-tolyl)piperazin-1-ium-1-yl]methyl]phenol CAS Name: 2-ethoxy-4-[[4-(2-methylphenyl)-1-piperazin-1-iumyl]methyl]phenol IUPAC Name: 2-ethoxy-4-[[4-(2-methylphenyl)piperazin-1-ium-1-yl]methyl]phenol Traditional Name: 2-ethoxy-4-[[4-(o-tolyl)piperazin-1-ium-1-yl]methyl]phenol Formula: C20H27N2O2+ MolecularWeight: 327.44058

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH+]2CCN(CC2)C3=CC=CC=C3C)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH+]2CCN(CC2)C3=CC=CC=C3C)O

InChI

InChI=1S/C20H26N2O2/c1-3-24-20-14-17(8-9-19(20)23)15-21-10-12-22(13-11-21)18-7-5-4-6-16(18)2/h4-9,14,23H,3,10-13,15H2,1-2H3/p+1