2-[[1-[(3-ethynylphenyl)amino]-6-(2-hydroxyethyloxy)-8aH-quinazolin-7-yl]oxy]ethanol

Systemtic Name: 2-[[1-[(3-ethynylphenyl)amino]-6-(2-hydroxyethyloxy)-8aH-quinazolin-7-yl]oxy]ethanol Openeye Name: 2-[[1-(3-ethynylanilino)-6-(2-hydroxyethoxy)-8aH-quinazolin-7-yl]oxy]ethanol CAS Name: 2-[[1-(3-ethynylanilino)-6-(2-hydroxyethoxy)-8aH-quinazolin-7-yl]oxy]ethanol IUPAC Name: 2-[[1-(3-ethynylanilino)-6-(2-hydroxyethoxy)-8aH-quinazolin-7-yl]oxy]ethanol Traditional Name: 2-[[1-(3-ethynylanilino)-6-(2-hydroxyethoxy)-8aH-quinazolin-7-yl]oxy]ethanol Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NN2C=NC=C3C2C=C(C(=C3)OCCO)OCCO

Isomeric SMILES

C#CC1=CC(=CC=C1)NN2C=NC=C3C2C=C(C(=C3)OCCO)OCCO

InChI

InChI=1S/C20H21N3O4/c1-2-15-4-3-5-17(10-15)22-23-14-21-13-16-11-19(26-8-6-24)20(12-18(16)23)27-9-7-25/h1,3-5,10-14,18,22,24-25H,6-9H2