2-[4-[(3-ethynylphenyl)amino]-7-(2-methoxyethoxy)quinazolin-6-yl]oxyethanol

Systemtic Name: 2-[4-[(3-ethynylphenyl)amino]-7-(2-methoxyethoxy)quinazolin-6-yl]oxyethanol Openeye Name: 2-[4-(3-ethynylanilino)-7-(2-methoxyethoxy)quinazolin-6-yl]oxyethanol CAS Name: 2-[[4-(3-ethynylanilino)-7-(2-methoxyethoxy)-6-quinazolinyl]oxy]ethanol IUPAC Name: 2-[4-(3-ethynylanilino)-7-(2-methoxyethoxy)quinazolin-6-yl]oxyethanol Traditional Name: 2-[4-(3-ethynylanilino)-7-(2-methoxyethoxy)quinazolin-6-yl]oxyethanol Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C2C(=C1)N=CN=C2NC3=CC=CC(=C3)C#C)OCCO

Isomeric SMILES

COCCOC1=C(C=C2C(=C1)N=CN=C2NC3=CC=CC(=C3)C#C)OCCO

InChI

InChI=1S/C21H21N3O4/c1-3-15-5-4-6-16(11-15)24-21-17-12-19(27-8-7-25)20(28-10-9-26-2)13-18(17)22-14-23-21/h1,4-6,11-14,25H,7-10H2,2H3,(H,22,23,24)