2-[(4-methylphenyl)carbonylamino]-3-[3-(trifluoromethyl)phenyl]propanoic acid

Systemtic Name: 2-[(4-methylphenyl)carbonylamino]-3-[3-(trifluoromethyl)phenyl]propanoic acid Openeye Name: 2-[(4-methylbenzoyl)amino]-3-[3-(trifluoromethyl)phenyl]propanoic acid CAS Name: 2-[[(4-methylphenyl)-oxomethyl]amino]-3-[3-(trifluoromethyl)phenyl]propanoic acid IUPAC Name: 2-[(4-methylbenzoyl)amino]-3-[3-(trifluoromethyl)phenyl]propanoic acid Traditional Name: 2-(p-toluoylamino)-3-[3-(trifluoromethyl)phenyl]propionic acid Formula: C18H16F3NO3 MolecularWeight: 351.31975

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(CC2=CC(=CC=C2)C(F)(F)F)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(CC2=CC(=CC=C2)C(F)(F)F)C(=O)O

InChI

InChI=1S/C18H16F3NO3/c1-11-5-7-13(8-6-11)16(23)22-15(17(24)25)10-12-3-2-4-14(9-12)18(19,20)21/h2-9,15H,10H2,1H3,(H,22,23)(H,24,25)