[(3R)-1-[(5-methyl-1-propyl-pyrazol-4-yl)methyl]-3-phenethyl-piperidin-1-ium-3-yl]methanol

Systemtic Name: [(3R)-1-[(5-methyl-1-propyl-pyrazol-4-yl)methyl]-3-phenethyl-piperidin-1-ium-3-yl]methanol Openeye Name: [(3R)-1-[(5-methyl-1-propyl-pyrazol-4-yl)methyl]-3-phenethyl-piperidin-1-ium-3-yl]methanol CAS Name: [(3R)-1-[(5-methyl-1-propyl-4-pyrazolyl)methyl]-3-phenethyl-3-piperidin-1-iumyl]methanol IUPAC Name: [(3R)-1-[(5-methyl-1-propylpyrazol-4-yl)methyl]-3-phenethylpiperidin-1-ium-3-yl]methanol Traditional Name: [(3R)-1-[(5-methyl-1-propyl-pyrazol-4-yl)methyl]-3-phenethyl-piperidin-1-ium-3-yl]methanol Formula: C22H34N3O+ MolecularWeight: 356.52486

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C=N1)C[NH+]2CCCC(C2)(CCC3=CC=CC=C3)CO)C

Isomeric SMILES

CCCN1C(=C(C=N1)C[NH+]2CCC[C@@](C2)(CCC3=CC=CC=C3)CO)C

InChI

InChI=1S/C22H33N3O/c1-3-13-25-19(2)21(15-23-25)16-24-14-7-11-22(17-24,18-26)12-10-20-8-5-4-6-9-20/h4-6,8-9,15,26H,3,7,10-14,16-18H2,1-2H3/p+1/t22-/m0/s1