2-[4-[(2-fluoranyl-4-methyl-5-phenylmethoxy-phenyl)amino]-6-methoxy-quinazolin-7-yl]oxyethyl ethanoate

Systemtic Name: 2-[4-[(2-fluoranyl-4-methyl-5-phenylmethoxy-phenyl)amino]-6-methoxy-quinazolin-7-yl]oxyethyl ethanoate Openeye Name: 2-[4-(5-benzyloxy-2-fluoro-4-methyl-anilino)-6-methoxy-quinazolin-7-yl]oxyethyl acetate CAS Name: acetic acid 2-[[4-(2-fluoro-4-methyl-5-phenylmethoxyanilino)-6-methoxy-7-quinazolinyl]oxy]ethyl ester IUPAC Name: 2-[4-(2-fluoro-4-methyl-5-phenylmethoxyanilino)-6-methoxyquinazolin-7-yl]oxyethyl acetate Traditional Name: acetic acid 2-[4-(5-benzoxy-2-fluoro-4-methyl-anilino)-6-methoxy-quinazolin-7-yl]oxyethyl ester Formula: C27H26FN3O5 MolecularWeight: 491.510843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1OCC2=CC=CC=C2)NC3=NC=NC4=CC(=C(C=C43)OC)OCCOC(=O)C)F

Isomeric SMILES

CC1=CC(=C(C=C1OCC2=CC=CC=C2)NC3=NC=NC4=CC(=C(C=C43)OC)OCCOC(=O)C)F

InChI

InChI=1S/C27H26FN3O5/c1-17-11-21(28)23(14-24(17)36-15-19-7-5-4-6-8-19)31-27-20-12-25(33-3)26(13-22(20)29-16-30-27)35-10-9-34-18(2)32/h4-8,11-14,16H,9-10,15H2,1-3H3,(H,29,30,31)