2-[[(4-methoxyphenyl)methylamino]methyl]-7-(trifluoromethyl)-1H-quinazolin-4-one

Systemtic Name: 2-[[(4-methoxyphenyl)methylamino]methyl]-7-(trifluoromethyl)-1H-quinazolin-4-one Openeye Name: 2-[[(4-methoxyphenyl)methylamino]methyl]-7-(trifluoromethyl)-1H-quinazolin-4-one CAS Name: 2-[[(4-methoxyphenyl)methylamino]methyl]-7-(trifluoromethyl)-1H-quinazolin-4-one IUPAC Name: 2-[[(4-methoxyphenyl)methylamino]methyl]-7-(trifluoromethyl)-1H-quinazolin-4-one Traditional Name: 2-[(p-anisylamino)methyl]-7-(trifluoromethyl)-1H-quinazolin-4-one Formula: C18H16F3N3O2 MolecularWeight: 363.33375

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNCC2=NC(=O)C3=C(N2)C=C(C=C3)C(F)(F)F

Isomeric SMILES

COC1=CC=C(C=C1)CNCC2=NC(=O)C3=C(N2)C=C(C=C3)C(F)(F)F

InChI

InChI=1S/C18H16F3N3O2/c1-26-13-5-2-11(3-6-13)9-22-10-16-23-15-8-12(18(19,20)21)4-7-14(15)17(25)24-16/h2-8,22H,9-10H2,1H3,(H,23,24,25)