(2-azanyl-2-oxidanylidene-ethyl) 3,5-bis(trifluoromethyl)benzoate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 3,5-bis(trifluoromethyl)benzoate Openeye Name: (2-amino-2-oxo-ethyl) 3,5-bis(trifluoromethyl)benzoate CAS Name: 3,5-bis(trifluoromethyl)benzoic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 3,5-bis(trifluoromethyl)benzoate Traditional Name: 3,5-bis(trifluoromethyl)benzoic acid (2-amino-2-keto-ethyl) ester Formula: C11H7F6NO3 MolecularWeight: 315.168599

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C(=O)OCC(=O)N

Isomeric SMILES

C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C(=O)OCC(=O)N

InChI

InChI=1S/C11H7F6NO3/c12-10(13,14)6-1-5(9(20)21-4-8(18)19)2-7(3-6)11(15,16)17/h1-3H,4H2,(H2,18,19)