N-[3-(3-fluorophenyl)phenyl]-1-[(5-methyl-1-propyl-pyrazol-4-yl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-[3-(3-fluorophenyl)phenyl]-1-[(5-methyl-1-propyl-pyrazol-4-yl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: N-[3-(3-fluorophenyl)phenyl]-1-[(5-methyl-1-propyl-pyrazol-4-yl)methyl]piperidin-1-ium-4-carboxamide CAS Name: N-[3-(3-fluorophenyl)phenyl]-1-[(5-methyl-1-propyl-4-pyrazolyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-[3-(3-fluorophenyl)phenyl]-1-[(5-methyl-1-propylpyrazol-4-yl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: N-[3-(3-fluorophenyl)phenyl]-1-[(5-methyl-1-propyl-pyrazol-4-yl)methyl]piperidin-1-ium-4-carboxamide Formula: C26H32FN4O+ MolecularWeight: 435.556883

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C=N1)C[NH+]2CCC(CC2)C(=O)NC3=CC=CC(=C3)C4=CC(=CC=C4)F)C

Isomeric SMILES

CCCN1C(=C(C=N1)C[NH+]2CCC(CC2)C(=O)NC3=CC=CC(=C3)C4=CC(=CC=C4)F)C

InChI

InChI=1S/C26H31FN4O/c1-3-12-31-19(2)23(17-28-31)18-30-13-10-20(11-14-30)26(32)29-25-9-5-7-22(16-25)21-6-4-8-24(27)15-21/h4-9,15-17,20H,3,10-14,18H2,1-2H3,(H,29,32)/p+1