phenylcarbonyloxymethyl 2-[[7-(trifluoromethyl)quinolin-4-yl]amino]benzoate

Systemtic Name: phenylcarbonyloxymethyl 2-[[7-(trifluoromethyl)quinolin-4-yl]amino]benzoate Openeye Name: benzoyloxymethyl 2-[[7-(trifluoromethyl)-4-quinolyl]amino]benzoate CAS Name: 2-[[7-(trifluoromethyl)-4-quinolinyl]amino]benzoic acid benzoyloxymethyl ester IUPAC Name: benzoyloxymethyl 2-[[7-(trifluoromethyl)quinolin-4-yl]amino]benzoate Traditional Name: 2-[[7-(trifluoromethyl)-4-quinolyl]amino]benzoic acid benzoyloxymethyl ester Formula: C25H17F3N2O4 MolecularWeight: 466.40869

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCOC(=O)C2=CC=CC=C2NC3=C4C=CC(=CC4=NC=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCOC(=O)C2=CC=CC=C2NC3=C4C=CC(=CC4=NC=C3)C(F)(F)F

InChI

InChI=1S/C25H17F3N2O4/c26-25(27,28)17-10-11-18-21(12-13-29-22(18)14-17)30-20-9-5-4-8-19(20)24(32)34-15-33-23(31)16-6-2-1-3-7-16/h1-14H,15H2,(H,29,30)