2-[(6-ethylquinazolin-4-yl)-(2-oxidanidyl-2-oxidanylidene-ethyl)amino]ethanoate

Systemtic Name: 2-[(6-ethylquinazolin-4-yl)-(2-oxidanidyl-2-oxidanylidene-ethyl)amino]ethanoate Openeye Name: 2-[(6-ethylquinazolin-4-yl)-(2-oxido-2-oxo-ethyl)amino]acetate CAS Name: 2-[(6-ethyl-4-quinazolinyl)-(2-oxido-2-oxoethyl)amino]acetate IUPAC Name: 2-[(6-ethylquinazolin-4-yl)-(2-oxido-2-oxoethyl)amino]acetate Traditional Name: 2-[(6-ethylquinazolin-4-yl)-(2-keto-2-oxido-ethyl)amino]acetate Formula: C14H13N3O4-2 MolecularWeight: 287.27072

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=CN=C2N(CC(=O)[O-])CC(=O)[O-]

Isomeric SMILES

CCC1=CC2=C(C=C1)N=CN=C2N(CC(=O)[O-])CC(=O)[O-]

InChI

InChI=1S/C14H15N3O4/c1-2-9-3-4-11-10(5-9)14(16-8-15-11)17(6-12(18)19)7-13(20)21/h3-5,8H,2,6-7H2,1H3,(H,18,19)(H,20,21)/p-2