2-[(6,7-dimethoxyquinazolin-4-yl)azaniumyl]ethanoate

Systemtic Name: 2-[(6,7-dimethoxyquinazolin-4-yl)azaniumyl]ethanoate Openeye Name: 2-[(6,7-dimethoxyquinazolin-4-yl)ammonio]acetate CAS Name: 2-[(6,7-dimethoxy-4-quinazolinyl)ammonio]acetate IUPAC Name: 2-[(6,7-dimethoxyquinazolin-4-yl)azaniumyl]acetate Traditional Name: 2-[(6,7-dimethoxyquinazolin-4-yl)ammonio]acetate Formula: C12H13N3O4 MolecularWeight: 263.24932

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)[NH2+]CC(=O)[O-])OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)[NH2+]CC(=O)[O-])OC

InChI

InChI=1S/C12H13N3O4/c1-18-9-3-7-8(4-10(9)19-2)14-6-15-12(7)13-5-11(16)17/h3-4,6H,5H2,1-2H3,(H,16,17)(H,13,14,15)