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

Systemtic Name: 4-methoxy-2-[[4-(4-naphthalen-2-yl-1H-pyrazol-5-yl)piperidin-1-ium-1-yl]methyl]phenol Openeye Name: 4-methoxy-2-[[4-[4-(2-naphthyl)-1H-pyrazol-5-yl]piperidin-1-ium-1-yl]methyl]phenol CAS Name: 4-methoxy-2-[[4-[4-(2-naphthalenyl)-1H-pyrazol-5-yl]-1-piperidin-1-iumyl]methyl]phenol IUPAC Name: 4-methoxy-2-[[4-(4-naphthalen-2-yl-1H-pyrazol-5-yl)piperidin-1-ium-1-yl]methyl]phenol Traditional Name: 4-methoxy-2-[[4-[4-(2-naphthyl)-1H-pyrazol-5-yl]piperidin-1-ium-1-yl]methyl]phenol Formula: C26H28N3O2+ MolecularWeight: 414.51942

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)O)C[NH+]2CCC(CC2)C3=C(C=NN3)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

COC1=CC(=C(C=C1)O)C[NH+]2CCC(CC2)C3=C(C=NN3)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C26H27N3O2/c1-31-23-8-9-25(30)22(15-23)17-29-12-10-19(11-13-29)26-24(16-27-28-26)21-7-6-18-4-2-3-5-20(18)14-21/h2-9,14-16,19,30H,10-13,17H2,1H3,(H,27,28)/p+1