methyl 3-[2-(3-fluorophenyl)ethylcarbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[2-(3-fluorophenyl)ethylcarbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[2-(3-fluorophenyl)ethylcarbamoyl]-5-nitro-benzoate CAS Name: 3-[[2-(3-fluorophenyl)ethylamino]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[2-(3-fluorophenyl)ethylcarbamoyl]-5-nitrobenzoate Traditional Name: 3-[2-(3-fluorophenyl)ethylcarbamoyl]-5-nitro-benzoic acid methyl ester Formula: C17H15FN2O5 MolecularWeight: 346.309803

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)C(=O)NCCC2=CC(=CC=C2)F)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)C(=O)NCCC2=CC(=CC=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C17H15FN2O5/c1-25-17(22)13-8-12(9-15(10-13)20(23)24)16(21)19-6-5-11-3-2-4-14(18)7-11/h2-4,7-10H,5-6H2,1H3,(H,19,21)