3-[2-[4-[(3-methoxy-4-phenoxy-phenyl)amino]quinazolin-6-yl]ethynyl]-1-methyl-piperidin-3-ol

Systemtic Name: 3-[2-[4-[(3-methoxy-4-phenoxy-phenyl)amino]quinazolin-6-yl]ethynyl]-1-methyl-piperidin-3-ol Openeye Name: 3-[2-[4-(3-methoxy-4-phenoxy-anilino)quinazolin-6-yl]ethynyl]-1-methyl-piperidin-3-ol CAS Name: 3-[2-[4-(3-methoxy-4-phenoxyanilino)-6-quinazolinyl]ethynyl]-1-methyl-3-piperidinol IUPAC Name: 3-[2-[4-(3-methoxy-4-phenoxyanilino)quinazolin-6-yl]ethynyl]-1-methylpiperidin-3-ol Traditional Name: 3-[2-[4-(3-methoxy-4-phenoxy-anilino)quinazolin-6-yl]ethynyl]-1-methyl-piperidin-3-ol Formula: C29H28N4O3 MolecularWeight: 480.55762

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC(C1)(C#CC2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)OC5=CC=CC=C5)OC)O

Isomeric SMILES

CN1CCCC(C1)(C#CC2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)OC5=CC=CC=C5)OC)O

InChI

InChI=1S/C29H28N4O3/c1-33-16-6-14-29(34,19-33)15-13-21-9-11-25-24(17-21)28(31-20-30-25)32-22-10-12-26(27(18-22)35-2)36-23-7-4-3-5-8-23/h3-5,7-12,17-18,20,34H,6,14,16,19H2,1-2H3,(H,30,31,32)