ethyl 4-[[4-(trifluoromethyl)phenyl]amino]quinazoline-2-carboxylate

Systemtic Name: ethyl 4-[[4-(trifluoromethyl)phenyl]amino]quinazoline-2-carboxylate Openeye Name: ethyl 4-[4-(trifluoromethyl)anilino]quinazoline-2-carboxylate CAS Name: 4-[4-(trifluoromethyl)anilino]-2-quinazolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(trifluoromethyl)anilino]quinazoline-2-carboxylate Traditional Name: 4-[4-(trifluoromethyl)anilino]quinazoline-2-carboxylic acid ethyl ester Formula: C18H14F3N3O2 MolecularWeight: 361.31787

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC2=CC=CC=C2C(=N1)NC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=NC2=CC=CC=C2C(=N1)NC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C18H14F3N3O2/c1-2-26-17(25)16-23-14-6-4-3-5-13(14)15(24-16)22-12-9-7-11(8-10-12)18(19,20)21/h3-10H,2H2,1H3,(H,22,23,24)