ethyl 4-[4-[(3-ethynylphenyl)amino]-7-methoxy-quinazolin-6-yl]oxybutanoate

Systemtic Name: ethyl 4-[4-[(3-ethynylphenyl)amino]-7-methoxy-quinazolin-6-yl]oxybutanoate Openeye Name: ethyl 4-[4-(3-ethynylanilino)-7-methoxy-quinazolin-6-yl]oxybutanoate CAS Name: 4-[[4-(3-ethynylanilino)-7-methoxy-6-quinazolinyl]oxy]butanoic acid ethyl ester IUPAC Name: ethyl 4-[4-(3-ethynylanilino)-7-methoxyquinazolin-6-yl]oxybutanoate Traditional Name: 4-[4-(3-ethynylanilino)-7-methoxy-quinazolin-6-yl]oxybutyric acid ethyl ester Formula: C23H23N3O4 MolecularWeight: 405.44642

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCOC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC=CC(=C3)C#C)OC

Isomeric SMILES

CCOC(=O)CCCOC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC=CC(=C3)C#C)OC

InChI

InChI=1S/C23H23N3O4/c1-4-16-8-6-9-17(12-16)26-23-18-13-21(30-11-7-10-22(27)29-5-2)20(28-3)14-19(18)24-15-25-23/h1,6,8-9,12-15H,5,7,10-11H2,2-3H3,(H,24,25,26)