1-[2-[cyclohexyl-[(4-fluorophenyl)methyl]amino]-2-oxidanylidene-ethyl]-N-methyl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-[cyclohexyl-[(4-fluorophenyl)methyl]amino]-2-oxidanylidene-ethyl]-N-methyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-[cyclohexyl-[(4-fluorophenyl)methyl]amino]-2-oxo-ethyl]-N-methyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[2-[cyclohexyl-[(4-fluorophenyl)methyl]amino]-2-oxoethyl]-N-methyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-[cyclohexyl-[(4-fluorophenyl)methyl]amino]-2-oxoethyl]-N-methylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[2-[cyclohexyl-(4-fluorobenzyl)amino]-2-keto-ethyl]-N-methyl-piperidin-1-ium-4-carboxamide Formula: C22H33FN3O2+ MolecularWeight: 390.514723

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CC[NH+](CC1)CC(=O)N(CC2=CC=C(C=C2)F)C3CCCCC3

Isomeric SMILES

CNC(=O)C1CC[NH+](CC1)CC(=O)N(CC2=CC=C(C=C2)F)C3CCCCC3

InChI

InChI=1S/C22H32FN3O2/c1-24-22(28)18-11-13-25(14-12-18)16-21(27)26(20-5-3-2-4-6-20)15-17-7-9-19(23)10-8-17/h7-10,18,20H,2-6,11-16H2,1H3,(H,24,28)/p+1