(2R)-2-[(6,7-dimethoxyquinazolin-4-yl)azaniumyl]-3-oxidanyl-propanoate

Systemtic Name: (2R)-2-[(6,7-dimethoxyquinazolin-4-yl)azaniumyl]-3-oxidanyl-propanoate Openeye Name: (2R)-2-[(6,7-dimethoxyquinazolin-4-yl)ammonio]-3-hydroxy-propanoate CAS Name: (2R)-2-[(6,7-dimethoxy-4-quinazolinyl)ammonio]-3-hydroxypropanoate IUPAC Name: (2R)-2-[(6,7-dimethoxyquinazolin-4-yl)azaniumyl]-3-hydroxypropanoate Traditional Name: (2R)-2-[(6,7-dimethoxyquinazolin-4-yl)ammonio]-3-hydroxy-propionate Formula: C13H15N3O5 MolecularWeight: 293.2753

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15N3O5/c1-20-10-3-7-8(4-11(10)21-2)14-6-15-12(7)16-9(5-17)13(18)19/h3-4,6,9,17H,5H2,1-2H3,(H,18,19)(H,14,15,16)/t9-/m1/s1