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

Systemtic Name: 2-ethoxy-4-[[4-(phenylmethyl)piperazin-1-ium-1-yl]methyl]phenol Openeye Name: 4-[(4-benzylpiperazin-1-ium-1-yl)methyl]-2-ethoxy-phenol CAS Name: 2-ethoxy-4-[[4-(phenylmethyl)-1-piperazin-1-iumyl]methyl]phenol IUPAC Name: 4-[(4-benzylpiperazin-1-ium-1-yl)methyl]-2-ethoxyphenol Traditional Name: 4-[(4-benzylpiperazin-1-ium-1-yl)methyl]-2-ethoxy-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)CC3=CC=CC=C3)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH+]2CCN(CC2)CC3=CC=CC=C3)O

InChI

InChI=1S/C20H26N2O2/c1-2-24-20-14-18(8-9-19(20)23)16-22-12-10-21(11-13-22)15-17-6-4-3-5-7-17/h3-9,14,23H,2,10-13,15-16H2,1H3/p+1