4-methoxy-2-[[4-[(3-methylphenyl)methyl]piperazin-1-ium-1-yl]methyl]phenol

Systemtic Name: 4-methoxy-2-[[4-[(3-methylphenyl)methyl]piperazin-1-ium-1-yl]methyl]phenol Openeye Name: 4-methoxy-2-[[4-(m-tolylmethyl)piperazin-1-ium-1-yl]methyl]phenol CAS Name: 4-methoxy-2-[[4-[(3-methylphenyl)methyl]-1-piperazin-1-iumyl]methyl]phenol IUPAC Name: 4-methoxy-2-[[4-[(3-methylphenyl)methyl]piperazin-1-ium-1-yl]methyl]phenol Traditional Name: 4-methoxy-2-[[4-(3-methylbenzyl)piperazin-1-ium-1-yl]methyl]phenol Formula: C20H27N2O2+ MolecularWeight: 327.44058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CC[NH+](CC2)CC3=C(C=CC(=C3)OC)O

Isomeric SMILES

CC1=CC(=CC=C1)CN2CC[NH+](CC2)CC3=C(C=CC(=C3)OC)O

InChI

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