[2-[2-(2-fluorophenyl)carbonylhydrazinyl]-2-oxidanylidene-ethyl] 3-methyl-2-nitro-benzoate

Systemtic Name: [2-[2-(2-fluorophenyl)carbonylhydrazinyl]-2-oxidanylidene-ethyl] 3-methyl-2-nitro-benzoate Openeye Name: [2-[2-(2-fluorobenzoyl)hydrazino]-2-oxo-ethyl] 3-methyl-2-nitro-benzoate CAS Name: 3-methyl-2-nitrobenzoic acid [2-[[(2-fluorophenyl)-oxomethyl]hydrazo]-2-oxoethyl] ester IUPAC Name: [2-[2-(2-fluorobenzoyl)hydrazinyl]-2-oxoethyl] 3-methyl-2-nitrobenzoate Traditional Name: 3-methyl-2-nitro-benzoic acid [2-[N'-(2-fluorobenzoyl)hydrazino]-2-keto-ethyl] ester Formula: C17H14FN3O6 MolecularWeight: 375.307963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)OCC(=O)NNC(=O)C2=CC=CC=C2F

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)OCC(=O)NNC(=O)C2=CC=CC=C2F

InChI

InChI=1S/C17H14FN3O6/c1-10-5-4-7-12(15(10)21(25)26)17(24)27-9-14(22)19-20-16(23)11-6-2-3-8-13(11)18/h2-8H,9H2,1H3,(H,19,22)(H,20,23)