[2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethyl] 5-[(4-fluorophenyl)amino]-5-oxidanylidene-pentanoate

Systemtic Name: [2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethyl] 5-[(4-fluorophenyl)amino]-5-oxidanylidene-pentanoate Openeye Name: [2-(3-nitroanilino)-2-oxo-ethyl] 5-(4-fluoroanilino)-5-oxo-pentanoate CAS Name: 5-(4-fluoroanilino)-5-oxopentanoic acid [2-(3-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-nitroanilino)-2-oxoethyl] 5-(4-fluoroanilino)-5-oxopentanoate Traditional Name: 5-(4-fluoroanilino)-5-keto-valeric acid [2-keto-2-(3-nitroanilino)ethyl] ester Formula: C19H18FN3O6 MolecularWeight: 403.361123

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)COC(=O)CCCC(=O)NC2=CC=C(C=C2)F

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)COC(=O)CCCC(=O)NC2=CC=C(C=C2)F

InChI

InChI=1S/C19H18FN3O6/c20-13-7-9-14(10-8-13)21-17(24)5-2-6-19(26)29-12-18(25)22-15-3-1-4-16(11-15)23(27)28/h1,3-4,7-11H,2,5-6,12H2,(H,21,24)(H,22,25)