3-[4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-6-(cyclopropylmethoxy)quinazolin-7-yl]oxypropan-1-ol

Systemtic Name: 3-[4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-6-(cyclopropylmethoxy)quinazolin-7-yl]oxypropan-1-ol Openeye Name: 3-[4-(3-chloro-4-fluoro-anilino)-6-(cyclopropylmethoxy)quinazolin-7-yl]oxypropan-1-ol CAS Name: 3-[[4-(3-chloro-4-fluoroanilino)-6-(cyclopropylmethoxy)-7-quinazolinyl]oxy]-1-propanol IUPAC Name: 3-[4-(3-chloro-4-fluoroanilino)-6-(cyclopropylmethoxy)quinazolin-7-yl]oxypropan-1-ol Traditional Name: 3-[4-(3-chloro-4-fluoro-anilino)-6-(cyclopropylmethoxy)quinazolin-7-yl]oxypropan-1-ol Formula: C21H21ClFN3O3 MolecularWeight: 417.861143

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1COC2=C(C=C3C(=C2)C(=NC=N3)NC4=CC(=C(C=C4)F)Cl)OCCCO

Isomeric SMILES

C1CC1COC2=C(C=C3C(=C2)C(=NC=N3)NC4=CC(=C(C=C4)F)Cl)OCCCO

InChI

InChI=1S/C21H21ClFN3O3/c22-16-8-14(4-5-17(16)23)26-21-15-9-19(29-11-13-2-3-13)20(28-7-1-6-27)10-18(15)24-12-25-21/h4-5,8-10,12-13,27H,1-3,6-7,11H2,(H,24,25,26)