3-azanyl-2-methyl-4-[2-[4-(trifluoromethyl)phenyl]phenyl]carbonyl-benzoic acid

Systemtic Name: 3-azanyl-2-methyl-4-[2-[4-(trifluoromethyl)phenyl]phenyl]carbonyl-benzoic acid Openeye Name: 3-amino-2-methyl-4-[2-[4-(trifluoromethyl)phenyl]benzoyl]benzoic acid CAS Name: 3-amino-2-methyl-4-[oxo-[2-[4-(trifluoromethyl)phenyl]phenyl]methyl]benzoic acid IUPAC Name: 3-amino-2-methyl-4-[2-[4-(trifluoromethyl)phenyl]benzoyl]benzoic acid Traditional Name: 3-amino-2-methyl-4-[2-[4-(trifluoromethyl)phenyl]benzoyl]benzoic acid Formula: C22H16F3NO3 MolecularWeight: 399.36255

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1N)C(=O)C2=CC=CC=C2C3=CC=C(C=C3)C(F)(F)F)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1N)C(=O)C2=CC=CC=C2C3=CC=C(C=C3)C(F)(F)F)C(=O)O

InChI

InChI=1S/C22H16F3NO3/c1-12-15(21(28)29)10-11-18(19(12)26)20(27)17-5-3-2-4-16(17)13-6-8-14(9-7-13)22(23,24)25/h2-11H,26H2,1H3,(H,28,29)