methyl 4-[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethoxy]-3-nitro-benzoate

Systemtic Name: methyl 4-[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethoxy]-3-nitro-benzoate Openeye Name: methyl 4-[2-[(4-fluorophenyl)methylamino]-2-oxo-ethoxy]-3-nitro-benzoate CAS Name: 4-[2-[(4-fluorophenyl)methylamino]-2-oxoethoxy]-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-[2-[(4-fluorophenyl)methylamino]-2-oxoethoxy]-3-nitrobenzoate Traditional Name: 4-[2-[(4-fluorobenzyl)amino]-2-keto-ethoxy]-3-nitro-benzoic acid methyl ester Formula: C17H15FN2O6 MolecularWeight: 362.309203

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)OCC(=O)NCC2=CC=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)OCC(=O)NCC2=CC=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C17H15FN2O6/c1-25-17(22)12-4-7-15(14(8-12)20(23)24)26-10-16(21)19-9-11-2-5-13(18)6-3-11/h2-8H,9-10H2,1H3,(H,19,21)