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

Systemtic Name: 1-[2-[[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-[[2-(4-fluoroanilino)-2-oxo-ethyl]amino]-2-oxo-ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[2-[[2-(4-fluoroanilino)-2-oxoethyl]amino]-2-oxoethyl]-N-phenyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-[[2-(4-fluoroanilino)-2-oxoethyl]amino]-2-oxoethyl]-N-phenylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[2-[[2-(4-fluoroanilino)-2-keto-ethyl]amino]-2-keto-ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide Formula: C22H26FN4O3+ MolecularWeight: 413.465243

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NC2=CC=CC=C2)CC(=O)NCC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

C1C[NH+](CCC1C(=O)NC2=CC=CC=C2)CC(=O)NCC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C22H25FN4O3/c23-17-6-8-19(9-7-17)25-20(28)14-24-21(29)15-27-12-10-16(11-13-27)22(30)26-18-4-2-1-3-5-18/h1-9,16H,10-15H2,(H,24,29)(H,25,28)(H,26,30)/p+1