3-[2-[4-[(3-phenoxyphenyl)amino]quinazolin-6-yl]ethynyl]pyrrolidin-3-ol

Systemtic Name: 3-[2-[4-[(3-phenoxyphenyl)amino]quinazolin-6-yl]ethynyl]pyrrolidin-3-ol Openeye Name: 3-[2-[4-(3-phenoxyanilino)quinazolin-6-yl]ethynyl]pyrrolidin-3-ol CAS Name: 3-[2-[4-(3-phenoxyanilino)-6-quinazolinyl]ethynyl]-3-pyrrolidinol IUPAC Name: 3-[2-[4-(3-phenoxyanilino)quinazolin-6-yl]ethynyl]pyrrolidin-3-ol Traditional Name: 3-[2-[4-(3-phenoxyanilino)quinazolin-6-yl]ethynyl]pyrrolidin-3-ol Formula: C26H22N4O2 MolecularWeight: 422.47848

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC1(C#CC2=CC3=C(C=C2)N=CN=C3NC4=CC(=CC=C4)OC5=CC=CC=C5)O

Isomeric SMILES

C1CNCC1(C#CC2=CC3=C(C=C2)N=CN=C3NC4=CC(=CC=C4)OC5=CC=CC=C5)O

InChI

InChI=1S/C26H22N4O2/c31-26(13-14-27-17-26)12-11-19-9-10-24-23(15-19)25(29-18-28-24)30-20-5-4-8-22(16-20)32-21-6-2-1-3-7-21/h1-10,15-16,18,27,31H,13-14,17H2,(H,28,29,30)