[4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-6-[[(2S)-oxolan-2-yl]methoxy]quinazolin-7-yl] ethanoate

Systemtic Name: [4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-6-[[(2S)-oxolan-2-yl]methoxy]quinazolin-7-yl] ethanoate Openeye Name: [4-(3-chloro-4-fluoro-anilino)-6-[[(2S)-tetrahydrofuran-2-yl]methoxy]quinazolin-7-yl] acetate CAS Name: acetic acid [4-(3-chloro-4-fluoroanilino)-6-[[(2S)-2-oxolanyl]methoxy]-7-quinazolinyl] ester IUPAC Name: [4-(3-chloro-4-fluoroanilino)-6-[[(2S)-oxolan-2-yl]methoxy]quinazolin-7-yl] acetate Traditional Name: acetic acid [4-(3-chloro-4-fluoro-anilino)-6-[[(2S)-tetrahydrofuran-2-yl]methoxy]quinazolin-7-yl] ester Formula: C21H19ClFN3O4 MolecularWeight: 431.844663

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C2C(=C1)N=CN=C2NC3=CC(=C(C=C3)F)Cl)OCC4CCCO4

Isomeric SMILES

CC(=O)OC1=C(C=C2C(=C1)N=CN=C2NC3=CC(=C(C=C3)F)Cl)OC[C@@H]4CCCO4

InChI

InChI=1S/C21H19ClFN3O4/c1-12(27)30-20-9-18-15(8-19(20)29-10-14-3-2-6-28-14)21(25-11-24-18)26-13-4-5-17(23)16(22)7-13/h4-5,7-9,11,14H,2-3,6,10H2,1H3,(H,24,25,26)/t14-/m0/s1