1-[4-[4-[(3-ethynylphenyl)amino]-7-methoxy-quinazolin-6-yl]oxypiperidin-1-yl]-2-oxidanyl-ethanone

Systemtic Name: 1-[4-[4-[(3-ethynylphenyl)amino]-7-methoxy-quinazolin-6-yl]oxypiperidin-1-yl]-2-oxidanyl-ethanone Openeye Name: 1-[4-[4-(3-ethynylanilino)-7-methoxy-quinazolin-6-yl]oxy-1-piperidyl]-2-hydroxy-ethanone CAS Name: 1-[4-[[4-(3-ethynylanilino)-7-methoxy-6-quinazolinyl]oxy]-1-piperidinyl]-2-hydroxyethanone IUPAC Name: 1-[4-[4-(3-ethynylanilino)-7-methoxyquinazolin-6-yl]oxypiperidin-1-yl]-2-hydroxyethanone Traditional Name: 1-[4-[4-(3-ethynylanilino)-7-methoxy-quinazolin-6-yl]oxypiperidino]-2-hydroxy-ethanone Formula: C24H24N4O4 MolecularWeight: 432.47176

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=CN=C2NC3=CC=CC(=C3)C#C)OC4CCN(CC4)C(=O)CO

Isomeric SMILES

COC1=C(C=C2C(=C1)N=CN=C2NC3=CC=CC(=C3)C#C)OC4CCN(CC4)C(=O)CO

InChI

InChI=1S/C24H24N4O4/c1-3-16-5-4-6-17(11-16)27-24-19-12-22(21(31-2)13-20(19)25-15-26-24)32-18-7-9-28(10-8-18)23(30)14-29/h1,4-6,11-13,15,18,29H,7-10,14H2,2H3,(H,25,26,27)