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3-nitro-2-[[3-(trifluoromethyl)phenyl]amino]benzoic acid

3-nitro-2-[[3-(trifluoromethyl)phenyl]amino]benzoic acid

Systemtic Name:3-nitro-2-[[3-(trifluoromethyl)phenyl]amino]benzoic acid
Openeye Name:3-nitro-2-[3-(trifluoromethyl)anilino]benzoic acid
CAS Name:3-nitro-2-[3-(trifluoromethyl)anilino]benzoic acid
IUPAC Name:3-nitro-2-[3-(trifluoromethyl)anilino]benzoic acid
Traditional Name:3-nitro-2-[3-(trifluoromethyl)anilino]benzoic acid
Formula: C14H9F3N2O4
MolecularWeight: 326.22747
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=C(C=CC=C2[N+](=O)[O-])C(=O)O)C(F)(F)F


Isomeric SMILES

C1=CC(=CC(=C1)NC2=C(C=CC=C2[N+](=O)[O-])C(=O)O)C(F)(F)F


InChI

InChI=1S/C14H9F3N2O4/c15-14(16,17)8-3-1-4-9(7-8)18-12-10(13(20)21)5-2-6-11(12)19(22)23/h1-7,18H,(H,20,21)


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