[4-[(4-bromanyl-2-fluoranyl-phenyl)amino]-7-methoxy-quinazolin-6-yl] ethanoate

Systemtic Name: [4-[(4-bromanyl-2-fluoranyl-phenyl)amino]-7-methoxy-quinazolin-6-yl] ethanoate Openeye Name: [4-(4-bromo-2-fluoro-anilino)-7-methoxy-quinazolin-6-yl] acetate CAS Name: acetic acid [4-(4-bromo-2-fluoroanilino)-7-methoxy-6-quinazolinyl] ester IUPAC Name: [4-(4-bromo-2-fluoroanilino)-7-methoxyquinazolin-6-yl] acetate Traditional Name: acetic acid [4-(4-bromo-2-fluoro-anilino)-7-methoxy-quinazolin-6-yl] ester Formula: C17H13BrFN3O3 MolecularWeight: 406.205823

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=C(C=C3)Br)F)OC

Isomeric SMILES

CC(=O)OC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=C(C=C3)Br)F)OC

InChI

InChI=1S/C17H13BrFN3O3/c1-9(23)25-16-6-11-14(7-15(16)24-2)20-8-21-17(11)22-13-4-3-10(18)5-12(13)19/h3-8H,1-2H3,(H,20,21,22)