ethyl 4-[2-(3,4-dimethoxyphenyl)ethylamino]-2-(trifluoromethyl)quinazoline-6-carboxylate

Systemtic Name: ethyl 4-[2-(3,4-dimethoxyphenyl)ethylamino]-2-(trifluoromethyl)quinazoline-6-carboxylate Openeye Name: ethyl 4-[2-(3,4-dimethoxyphenyl)ethylamino]-2-(trifluoromethyl)quinazoline-6-carboxylate CAS Name: 4-[2-(3,4-dimethoxyphenyl)ethylamino]-2-(trifluoromethyl)-6-quinazolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(3,4-dimethoxyphenyl)ethylamino]-2-(trifluoromethyl)quinazoline-6-carboxylate Traditional Name: 4-(homoveratrylamino)-2-(trifluoromethyl)quinazoline-6-carboxylic acid ethyl ester Formula: C22H22F3N3O4 MolecularWeight: 449.42299

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N=C(N=C2NCCC3=CC(=C(C=C3)OC)OC)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N=C(N=C2NCCC3=CC(=C(C=C3)OC)OC)C(F)(F)F

InChI

InChI=1S/C22H22F3N3O4/c1-4-32-20(29)14-6-7-16-15(12-14)19(28-21(27-16)22(23,24)25)26-10-9-13-5-8-17(30-2)18(11-13)31-3/h5-8,11-12H,4,9-10H2,1-3H3,(H,26,27,28)