ethyl 4-(3-oxidanylpropylamino)-2-(trifluoromethyl)quinazoline-6-carboxylate

Systemtic Name: ethyl 4-(3-oxidanylpropylamino)-2-(trifluoromethyl)quinazoline-6-carboxylate Openeye Name: ethyl 4-(3-hydroxypropylamino)-2-(trifluoromethyl)quinazoline-6-carboxylate CAS Name: 4-(3-hydroxypropylamino)-2-(trifluoromethyl)-6-quinazolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-hydroxypropylamino)-2-(trifluoromethyl)quinazoline-6-carboxylate Traditional Name: 4-(3-hydroxypropylamino)-2-(trifluoromethyl)quinazoline-6-carboxylic acid ethyl ester Formula: C15H16F3N3O3 MolecularWeight: 343.30105

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N=C(N=C2NCCCO)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N=C(N=C2NCCCO)C(F)(F)F

InChI

InChI=1S/C15H16F3N3O3/c1-2-24-13(23)9-4-5-11-10(8-9)12(19-6-3-7-22)21-14(20-11)15(16,17)18/h4-5,8,22H,2-3,6-7H2,1H3,(H,19,20,21)