[2-(3-fluorophenyl)-2-oxidanylidene-ethyl] 5-ethoxy-4-methoxy-2-nitro-benzoate

Systemtic Name: [2-(3-fluorophenyl)-2-oxidanylidene-ethyl] 5-ethoxy-4-methoxy-2-nitro-benzoate Openeye Name: [2-(3-fluorophenyl)-2-oxo-ethyl] 5-ethoxy-4-methoxy-2-nitro-benzoate CAS Name: 5-ethoxy-4-methoxy-2-nitrobenzoic acid [2-(3-fluorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-fluorophenyl)-2-oxoethyl] 5-ethoxy-4-methoxy-2-nitrobenzoate Traditional Name: 5-ethoxy-4-methoxy-2-nitro-benzoic acid [2-(3-fluorophenyl)-2-keto-ethyl] ester Formula: C18H16FNO7 MolecularWeight: 377.320543

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C(=O)OCC(=O)C2=CC(=CC=C2)F)[N+](=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C(=O)OCC(=O)C2=CC(=CC=C2)F)[N+](=O)[O-])OC

InChI

InChI=1S/C18H16FNO7/c1-3-26-17-8-13(14(20(23)24)9-16(17)25-2)18(22)27-10-15(21)11-5-4-6-12(19)7-11/h4-9H,3,10H2,1-2H3