[bis(trifluoromethyl)amino] 4-nitrobenzoate

Systemtic Name: [bis(trifluoromethyl)amino] 4-nitrobenzoate Openeye Name: [bis(trifluoromethyl)amino] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [bis(trifluoromethyl)amino] ester IUPAC Name: [bis(trifluoromethyl)amino] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [bis(trifluoromethyl)amino] ester Formula: C9H4F6N2O4 MolecularWeight: 318.129479

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)ON(C(F)(F)F)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)ON(C(F)(F)F)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C9H4F6N2O4/c10-8(11,12)17(9(13,14)15)21-7(18)5-1-3-6(4-2-5)16(19)20/h1-4H