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

Systemtic Name: 1-[2-[cyclohexyl-[(4-fluorophenyl)methyl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-[cyclohexyl-[(4-fluorophenyl)methyl]amino]-2-oxo-ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[2-[cyclohexyl-[(4-fluorophenyl)methyl]amino]-2-oxoethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-[cyclohexyl-[(4-fluorophenyl)methyl]amino]-2-oxoethyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[2-[cyclohexyl-(4-fluorobenzyl)amino]-2-keto-ethyl]piperidin-1-ium-4-carboxamide Formula: C21H31FN3O2+ MolecularWeight: 376.488143

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(CC2=CC=C(C=C2)F)C(=O)C[NH+]3CCC(CC3)C(=O)N

Isomeric SMILES

C1CCC(CC1)N(CC2=CC=C(C=C2)F)C(=O)C[NH+]3CCC(CC3)C(=O)N

InChI

InChI=1S/C21H30FN3O2/c22-18-8-6-16(7-9-18)14-25(19-4-2-1-3-5-19)20(26)15-24-12-10-17(11-13-24)21(23)27/h6-9,17,19H,1-5,10-15H2,(H2,23,27)/p+1