2-methoxy-5-[[4-[4-(3-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-ium-1-yl]methyl]phenol

Systemtic Name: 2-methoxy-5-[[4-[4-(3-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-ium-1-yl]methyl]phenol Openeye Name: 2-methoxy-5-[[4-[4-(m-tolyl)-1H-pyrazol-5-yl]piperidin-1-ium-1-yl]methyl]phenol CAS Name: 2-methoxy-5-[[4-[4-(3-methylphenyl)-1H-pyrazol-5-yl]-1-piperidin-1-iumyl]methyl]phenol IUPAC Name: 2-methoxy-5-[[4-[4-(3-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-ium-1-yl]methyl]phenol Traditional Name: 2-methoxy-5-[[4-[4-(m-tolyl)-1H-pyrazol-5-yl]piperidin-1-ium-1-yl]methyl]phenol Formula: C23H28N3O2+ MolecularWeight: 378.48732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=C(NN=C2)C3CC[NH+](CC3)CC4=CC(=C(C=C4)OC)O

Isomeric SMILES

CC1=CC=CC(=C1)C2=C(NN=C2)C3CC[NH+](CC3)CC4=CC(=C(C=C4)OC)O

InChI

InChI=1S/C23H27N3O2/c1-16-4-3-5-19(12-16)20-14-24-25-23(20)18-8-10-26(11-9-18)15-17-6-7-22(28-2)21(27)13-17/h3-7,12-14,18,27H,8-11,15H2,1-2H3,(H,24,25)/p+1