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4-acetamido-2-[2-nitro-4-(trifluoromethyl)phenoxy]benzoic acid

4-acetamido-2-[2-nitro-4-(trifluoromethyl)phenoxy]benzoic acid

Systemtic Name:4-acetamido-2-[2-nitro-4-(trifluoromethyl)phenoxy]benzoic acid
Openeye Name:4-acetamido-2-[2-nitro-4-(trifluoromethyl)phenoxy]benzoic acid
CAS Name:4-acetamido-2-[2-nitro-4-(trifluoromethyl)phenoxy]benzoic acid
IUPAC Name:4-acetamido-2-[2-nitro-4-(trifluoromethyl)phenoxy]benzoic acid
Traditional Name:4-acetamido-2-[2-nitro-4-(trifluoromethyl)phenoxy]benzoic acid
Formula: C16H11F3N2O6
MolecularWeight: 384.26355
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)C(=O)O)OC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]


Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)C(=O)O)OC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]


InChI

InChI=1S/C16H11F3N2O6/c1-8(22)20-10-3-4-11(15(23)24)14(7-10)27-13-5-2-9(16(17,18)19)6-12(13)21(25)26/h2-7H,1H3,(H,20,22)(H,23,24)


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