[1-[(1-methylpyrazol-4-yl)methyl]-4-phenethyl-piperidin-1-ium-4-yl]methanol

Systemtic Name: [1-[(1-methylpyrazol-4-yl)methyl]-4-phenethyl-piperidin-1-ium-4-yl]methanol Openeye Name: [1-[(1-methylpyrazol-4-yl)methyl]-4-phenethyl-piperidin-1-ium-4-yl]methanol CAS Name: [1-[(1-methyl-4-pyrazolyl)methyl]-4-phenethyl-4-piperidin-1-iumyl]methanol IUPAC Name: [1-[(1-methylpyrazol-4-yl)methyl]-4-phenethylpiperidin-1-ium-4-yl]methanol Traditional Name: [1-[(1-methylpyrazol-4-yl)methyl]-4-phenethyl-piperidin-1-ium-4-yl]methanol Formula: C19H28N3O+ MolecularWeight: 314.44512

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C[NH+]2CCC(CC2)(CCC3=CC=CC=C3)CO

Isomeric SMILES

CN1C=C(C=N1)C[NH+]2CCC(CC2)(CCC3=CC=CC=C3)CO

InChI

InChI=1S/C19H27N3O/c1-21-14-18(13-20-21)15-22-11-9-19(16-23,10-12-22)8-7-17-5-3-2-4-6-17/h2-6,13-14,23H,7-12,15-16H2,1H3/p+1