(4-azanylquinazolin-2-yl)methyl 3-fluoranyl-4-methyl-benzoate

Systemtic Name: (4-azanylquinazolin-2-yl)methyl 3-fluoranyl-4-methyl-benzoate Openeye Name: (4-aminoquinazolin-2-yl)methyl 3-fluoro-4-methyl-benzoate CAS Name: 3-fluoro-4-methylbenzoic acid (4-amino-2-quinazolinyl)methyl ester IUPAC Name: (4-aminoquinazolin-2-yl)methyl 3-fluoro-4-methylbenzoate Traditional Name: 3-fluoro-4-methyl-benzoic acid (4-aminoquinazolin-2-yl)methyl ester Formula: C17H14FN3O2 MolecularWeight: 311.310363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC2=NC3=CC=CC=C3C(=N2)N)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC2=NC3=CC=CC=C3C(=N2)N)F

InChI

InChI=1S/C17H14FN3O2/c1-10-6-7-11(8-13(10)18)17(22)23-9-15-20-14-5-3-2-4-12(14)16(19)21-15/h2-8H,9H2,1H3,(H2,19,20,21)