N-[1-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]cyclohexanecarboxamide

Systemtic Name: N-[1-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]cyclohexanecarboxamide Openeye Name: N-[1-[2-(4-fluoroanilino)-2-oxo-ethyl]piperidin-1-ium-4-yl]cyclohexanecarboxamide CAS Name: N-[1-[2-(4-fluoroanilino)-2-oxoethyl]-4-piperidin-1-iumyl]cyclohexanecarboxamide IUPAC Name: N-[1-[2-(4-fluoroanilino)-2-oxoethyl]piperidin-1-ium-4-yl]cyclohexanecarboxamide Traditional Name: N-[1-[2-(4-fluoroanilino)-2-keto-ethyl]piperidin-1-ium-4-yl]cyclohexanecarboxamide Formula: C20H29FN3O2+ MolecularWeight: 362.461563

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

C1CCC(CC1)C(=O)NC2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C20H28FN3O2/c21-16-6-8-17(9-7-16)22-19(25)14-24-12-10-18(11-13-24)23-20(26)15-4-2-1-3-5-15/h6-9,15,18H,1-5,10-14H2,(H,22,25)(H,23,26)/p+1