N-(1,3-benzodioxol-5-ylmethyl)-6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-amine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-6,7-dimethoxy-2-(trifluoromethyl)-4-quinazolinamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-amine Traditional Name: [6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-yl]-piperonyl-amine Formula: C19H16F3N3O4 MolecularWeight: 407.34325

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)C(F)(F)F)NCC3=CC4=C(C=C3)OCO4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)C(F)(F)F)NCC3=CC4=C(C=C3)OCO4)OC

InChI

InChI=1S/C19H16F3N3O4/c1-26-14-6-11-12(7-15(14)27-2)24-18(19(20,21)22)25-17(11)23-8-10-3-4-13-16(5-10)29-9-28-13/h3-7H,8-9H2,1-2H3,(H,23,24,25)