(2S)-2-[(6,7-dimethoxyquinazolin-4-yl)amino]-2-phenyl-ethanoate

Systemtic Name: (2S)-2-[(6,7-dimethoxyquinazolin-4-yl)amino]-2-phenyl-ethanoate Openeye Name: (2S)-2-[(6,7-dimethoxyquinazolin-4-yl)amino]-2-phenyl-acetate CAS Name: (2S)-2-[(6,7-dimethoxy-4-quinazolinyl)amino]-2-phenylacetate IUPAC Name: (2S)-2-[(6,7-dimethoxyquinazolin-4-yl)amino]-2-phenylacetate Traditional Name: (2S)-2-[(6,7-dimethoxyquinazolin-4-yl)amino]-2-phenyl-acetate Formula: C18H16N3O4- MolecularWeight: 338.33734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)NC(C3=CC=CC=C3)C(=O)[O-])OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)N[C@@H](C3=CC=CC=C3)C(=O)[O-])OC

InChI

InChI=1S/C18H17N3O4/c1-24-14-8-12-13(9-15(14)25-2)19-10-20-17(12)21-16(18(22)23)11-6-4-3-5-7-11/h3-10,16H,1-2H3,(H,22,23)(H,19,20,21)/p-1/t16-/m0/s1