[4-phenethyl-1-(3-pyrazol-1-ylpropyl)piperidin-1-ium-4-yl]methanol

Systemtic Name: [4-phenethyl-1-(3-pyrazol-1-ylpropyl)piperidin-1-ium-4-yl]methanol Openeye Name: [4-phenethyl-1-(3-pyrazol-1-ylpropyl)piperidin-1-ium-4-yl]methanol CAS Name: [4-phenethyl-1-[3-(1-pyrazolyl)propyl]-4-piperidin-1-iumyl]methanol IUPAC Name: [4-phenethyl-1-(3-pyrazol-1-ylpropyl)piperidin-1-ium-4-yl]methanol Traditional Name: [4-phenethyl-1-(3-pyrazol-1-ylpropyl)piperidin-1-ium-4-yl]methanol Formula: C20H30N3O+ MolecularWeight: 328.4717

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1(CCC2=CC=CC=C2)CO)CCCN3C=CC=N3

Isomeric SMILES

C1C[NH+](CCC1(CCC2=CC=CC=C2)CO)CCCN3C=CC=N3

InChI

InChI=1S/C20H29N3O/c24-18-20(9-8-19-6-2-1-3-7-19)10-16-22(17-11-20)13-5-15-23-14-4-12-21-23/h1-4,6-7,12,14,24H,5,8-11,13,15-18H2/p+1