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

Systemtic Name: [4-[(3-methoxyphenyl)methyl]-1-[(5-methyl-1-propyl-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]methanol Openeye Name: [4-[(3-methoxyphenyl)methyl]-1-[(5-methyl-1-propyl-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]methanol CAS Name: [4-[(3-methoxyphenyl)methyl]-1-[(5-methyl-1-propyl-4-pyrazolyl)methyl]-4-piperidin-1-iumyl]methanol IUPAC Name: [4-[(3-methoxyphenyl)methyl]-1-[(5-methyl-1-propylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]methanol Traditional Name: [4-m-anisyl-1-[(5-methyl-1-propyl-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]methanol Formula: C22H34N3O2+ MolecularWeight: 372.52426

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C=N1)C[NH+]2CCC(CC2)(CC3=CC(=CC=C3)OC)CO)C

Isomeric SMILES

CCCN1C(=C(C=N1)C[NH+]2CCC(CC2)(CC3=CC(=CC=C3)OC)CO)C

InChI

InChI=1S/C22H33N3O2/c1-4-10-25-18(2)20(15-23-25)16-24-11-8-22(17-26,9-12-24)14-19-6-5-7-21(13-19)27-3/h5-7,13,15,26H,4,8-12,14,16-17H2,1-3H3/p+1