1-[[3-[(3,5-dimethylpyrazol-1-yl)methyl]phenyl]methyl]-4-pyridin-2-yl-piperidin-1-ium-4-ol

Systemtic Name: 1-[[3-[(3,5-dimethylpyrazol-1-yl)methyl]phenyl]methyl]-4-pyridin-2-yl-piperidin-1-ium-4-ol Openeye Name: 1-[[3-[(3,5-dimethylpyrazol-1-yl)methyl]phenyl]methyl]-4-(2-pyridyl)piperidin-1-ium-4-ol CAS Name: 1-[[3-[(3,5-dimethyl-1-pyrazolyl)methyl]phenyl]methyl]-4-(2-pyridinyl)-4-piperidin-1-iumol IUPAC Name: 1-[[3-[(3,5-dimethylpyrazol-1-yl)methyl]phenyl]methyl]-4-pyridin-2-ylpiperidin-1-ium-4-ol Traditional Name: 1-[3-[(3,5-dimethylpyrazol-1-yl)methyl]benzyl]-4-(2-pyridyl)piperidin-1-ium-4-ol Formula: C23H29N4O+ MolecularWeight: 377.50256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC2=CC(=CC=C2)C[NH+]3CCC(CC3)(C4=CC=CC=N4)O)C

Isomeric SMILES

CC1=CC(=NN1CC2=CC(=CC=C2)C[NH+]3CCC(CC3)(C4=CC=CC=N4)O)C

InChI

InChI=1S/C23H28N4O/c1-18-14-19(2)27(25-18)17-21-7-5-6-20(15-21)16-26-12-9-23(28,10-13-26)22-8-3-4-11-24-22/h3-8,11,14-15,28H,9-10,12-13,16-17H2,1-2H3/p+1