[2-oxidanylidene-2-[3-(trifluoromethyl)phenyl]ethyl] 4-azanyl-5-chloranyl-2-methoxy-benzoate

Systemtic Name: [2-oxidanylidene-2-[3-(trifluoromethyl)phenyl]ethyl] 4-azanyl-5-chloranyl-2-methoxy-benzoate Openeye Name: [2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl] 4-amino-5-chloro-2-methoxy-benzoate CAS Name: 4-amino-5-chloro-2-methoxybenzoic acid [2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl] ester IUPAC Name: [2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl] 4-amino-5-chloro-2-methoxybenzoate Traditional Name: 4-amino-5-chloro-2-methoxy-benzoic acid [2-keto-2-[3-(trifluoromethyl)phenyl]ethyl] ester Formula: C17H13ClF3NO4 MolecularWeight: 387.73763

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)OCC(=O)C2=CC(=CC=C2)C(F)(F)F)Cl)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)OCC(=O)C2=CC(=CC=C2)C(F)(F)F)Cl)N

InChI

InChI=1S/C17H13ClF3NO4/c1-25-15-7-13(22)12(18)6-11(15)16(24)26-8-14(23)9-3-2-4-10(5-9)17(19,20)21/h2-7H,8,22H2,1H3