4-[2-[4-[(3-chloranyl-4-phenoxy-phenyl)amino]quinazolin-6-yl]ethynyl]oxan-4-ol

Systemtic Name: 4-[2-[4-[(3-chloranyl-4-phenoxy-phenyl)amino]quinazolin-6-yl]ethynyl]oxan-4-ol Openeye Name: 4-[2-[4-(3-chloro-4-phenoxy-anilino)quinazolin-6-yl]ethynyl]tetrahydropyran-4-ol CAS Name: 4-[2-[4-(3-chloro-4-phenoxyanilino)-6-quinazolinyl]ethynyl]-4-oxanol IUPAC Name: 4-[2-[4-(3-chloro-4-phenoxyanilino)quinazolin-6-yl]ethynyl]oxan-4-ol Traditional Name: 4-[2-[4-(3-chloro-4-phenoxy-anilino)quinazolin-6-yl]ethynyl]tetrahydropyran-4-ol Formula: C27H22ClN3O3 MolecularWeight: 471.93488

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1(C#CC2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)OC5=CC=CC=C5)Cl)O

Isomeric SMILES

C1COCCC1(C#CC2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)OC5=CC=CC=C5)Cl)O

InChI

InChI=1S/C27H22ClN3O3/c28-23-17-20(7-9-25(23)34-21-4-2-1-3-5-21)31-26-22-16-19(6-8-24(22)29-18-30-26)10-11-27(32)12-14-33-15-13-27/h1-9,16-18,32H,12-15H2,(H,29,30,31)