[2-[(3-bromophenyl)amino]-2-oxidanylidene-ethyl] 2-fluoranyl-4-methoxy-benzoate

Systemtic Name: [2-[(3-bromophenyl)amino]-2-oxidanylidene-ethyl] 2-fluoranyl-4-methoxy-benzoate Openeye Name: [2-(3-bromoanilino)-2-oxo-ethyl] 2-fluoro-4-methoxy-benzoate CAS Name: 2-fluoro-4-methoxybenzoic acid [2-(3-bromoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-bromoanilino)-2-oxoethyl] 2-fluoro-4-methoxybenzoate Traditional Name: 2-fluoro-4-methoxy-benzoic acid [2-(3-bromoanilino)-2-keto-ethyl] ester Formula: C16H13BrFNO4 MolecularWeight: 382.181123

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)OCC(=O)NC2=CC(=CC=C2)Br)F

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)OCC(=O)NC2=CC(=CC=C2)Br)F

InChI

InChI=1S/C16H13BrFNO4/c1-22-12-5-6-13(14(18)8-12)16(21)23-9-15(20)19-11-4-2-3-10(17)7-11/h2-8H,9H2,1H3,(H,19,20)