1-[(2-butyl-1H-imidazol-5-yl)methyl]-N-[3-(3-fluorophenyl)phenyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(2-butyl-1H-imidazol-5-yl)methyl]-N-[3-(3-fluorophenyl)phenyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(2-butyl-1H-imidazol-5-yl)methyl]-N-[3-(3-fluorophenyl)phenyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(2-butyl-1H-imidazol-5-yl)methyl]-N-[3-(3-fluorophenyl)phenyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(2-butyl-1H-imidazol-5-yl)methyl]-N-[3-(3-fluorophenyl)phenyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[(2-butyl-1H-imidazol-5-yl)methyl]-N-[3-(3-fluorophenyl)phenyl]piperidin-1-ium-4-carboxamide Formula: C26H32FN4O+ MolecularWeight: 435.556883

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=C(N1)C[NH+]2CCC(CC2)C(=O)NC3=CC=CC(=C3)C4=CC(=CC=C4)F

Isomeric SMILES

CCCCC1=NC=C(N1)C[NH+]2CCC(CC2)C(=O)NC3=CC=CC(=C3)C4=CC(=CC=C4)F

InChI

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