[4-[(2-chlorophenyl)methyl]-1-[(3-methyl-1-propyl-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]methanol

Systemtic Name: [4-[(2-chlorophenyl)methyl]-1-[(3-methyl-1-propyl-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]methanol Openeye Name: [4-[(2-chlorophenyl)methyl]-1-[(3-methyl-1-propyl-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]methanol CAS Name: [4-[(2-chlorophenyl)methyl]-1-[(3-methyl-1-propyl-4-pyrazolyl)methyl]-4-piperidin-1-iumyl]methanol IUPAC Name: [4-[(2-chlorophenyl)methyl]-1-[(3-methyl-1-propylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]methanol Traditional Name: [4-(2-chlorobenzyl)-1-[(3-methyl-1-propyl-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]methanol Formula: C21H31ClN3O+ MolecularWeight: 376.94334

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C(=N1)C)C[NH+]2CCC(CC2)(CC3=CC=CC=C3Cl)CO

Isomeric SMILES

CCCN1C=C(C(=N1)C)C[NH+]2CCC(CC2)(CC3=CC=CC=C3Cl)CO

InChI

InChI=1S/C21H30ClN3O/c1-3-10-25-15-19(17(2)23-25)14-24-11-8-21(16-26,9-12-24)13-18-6-4-5-7-20(18)22/h4-7,15,26H,3,8-14,16H2,1-2H3/p+1