1-[[(3R)-3-methyl-4-(3-methylphenyl)piperazin-1-ium-1-yl]methyl]naphthalen-2-ol

Systemtic Name: 1-[[(3R)-3-methyl-4-(3-methylphenyl)piperazin-1-ium-1-yl]methyl]naphthalen-2-ol Openeye Name: 1-[[(3R)-3-methyl-4-(m-tolyl)piperazin-1-ium-1-yl]methyl]naphthalen-2-ol CAS Name: 1-[[(3R)-3-methyl-4-(3-methylphenyl)-1-piperazin-1-iumyl]methyl]-2-naphthalenol IUPAC Name: 1-[[(3R)-3-methyl-4-(3-methylphenyl)piperazin-1-ium-1-yl]methyl]naphthalen-2-ol Traditional Name: 1-[[(3R)-3-methyl-4-(m-tolyl)piperazin-1-ium-1-yl]methyl]-2-naphthol Formula: C23H27N2O+ MolecularWeight: 347.47328

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Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH+](CCN1C2=CC=CC(=C2)C)CC3=C(C=CC4=CC=CC=C43)O

Isomeric SMILES

C[C@@H]1C[NH+](CCN1C2=CC=CC(=C2)C)CC3=C(C=CC4=CC=CC=C43)O

InChI

InChI=1S/C23H26N2O/c1-17-6-5-8-20(14-17)25-13-12-24(15-18(25)2)16-22-21-9-4-3-7-19(21)10-11-23(22)26/h3-11,14,18,26H,12-13,15-16H2,1-2H3/p+1/t18-/m1/s1