1-[2-[[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl]pyridin-1-ium-3-carboxamide

Systemtic Name: 1-[2-[[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl]pyridin-1-ium-3-carboxamide Openeye Name: 1-[2-[[2-(4-fluoroanilino)-2-oxo-ethyl]amino]-2-oxo-ethyl]pyridin-1-ium-3-carboxamide CAS Name: 1-[2-[[2-(4-fluoroanilino)-2-oxoethyl]amino]-2-oxoethyl]-3-pyridin-1-iumcarboxamide IUPAC Name: 1-[2-[[2-(4-fluoroanilino)-2-oxoethyl]amino]-2-oxoethyl]pyridin-1-ium-3-carboxamide Traditional Name: 1-[2-[[2-(4-fluoroanilino)-2-keto-ethyl]amino]-2-keto-ethyl]pyridin-1-ium-3-carboxamide Formula: C16H16FN4O3+ MolecularWeight: 331.321643

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C[N+](=C1)CC(=O)NCC(=O)NC2=CC=C(C=C2)F)C(=O)N

Isomeric SMILES

C1=CC(=C[N+](=C1)CC(=O)NCC(=O)NC2=CC=C(C=C2)F)C(=O)N

InChI

InChI=1S/C16H15FN4O3/c17-12-3-5-13(6-4-12)20-14(22)8-19-15(23)10-21-7-1-2-11(9-21)16(18)24/h1-7,9H,8,10H2,(H3-,18,19,20,22,23,24)/p+1