[2-[(4-chloranyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 3-(4-fluorophenyl)propanoate

Systemtic Name: [2-[(4-chloranyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 3-(4-fluorophenyl)propanoate Openeye Name: [2-(4-chloro-3-nitro-anilino)-2-oxo-ethyl] 3-(4-fluorophenyl)propanoate CAS Name: 3-(4-fluorophenyl)propanoic acid [2-(4-chloro-3-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-chloro-3-nitroanilino)-2-oxoethyl] 3-(4-fluorophenyl)propanoate Traditional Name: 3-(4-fluorophenyl)propionic acid [2-(4-chloro-3-nitro-anilino)-2-keto-ethyl] ester Formula: C17H14ClFN2O5 MolecularWeight: 380.754863

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC(=O)OCC(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])F

Isomeric SMILES

C1=CC(=CC=C1CCC(=O)OCC(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])F

InChI

InChI=1S/C17H14ClFN2O5/c18-14-7-6-13(9-15(14)21(24)25)20-16(22)10-26-17(23)8-3-11-1-4-12(19)5-2-11/h1-2,4-7,9H,3,8,10H2,(H,20,22)