2-nitro-4-[(E)-3-oxidanylidene-3-[2-(trifluoromethyl)phenyl]prop-1-enyl]phenolate

Systemtic Name: 2-nitro-4-[(E)-3-oxidanylidene-3-[2-(trifluoromethyl)phenyl]prop-1-enyl]phenolate Openeye Name: 2-nitro-4-[(E)-3-oxo-3-[2-(trifluoromethyl)phenyl]prop-1-enyl]phenolate CAS Name: 2-nitro-4-[(E)-3-oxo-3-[2-(trifluoromethyl)phenyl]prop-1-enyl]phenolate IUPAC Name: 2-nitro-4-[(E)-3-oxo-3-[2-(trifluoromethyl)phenyl]prop-1-enyl]phenolate Traditional Name: 4-[(E)-3-keto-3-[2-(trifluoromethyl)phenyl]prop-1-enyl]-2-nitro-phenolate Formula: C16H9F3NO4- MolecularWeight: 336.24217

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)C=CC2=CC(=C(C=C2)[O-])[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

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

InChI

InChI=1S/C16H10F3NO4/c17-16(18,19)12-4-2-1-3-11(12)14(21)7-5-10-6-8-15(22)13(9-10)20(23)24/h1-9,22H/p-1/b7-5+