3-[3,4-dimethyl-6,7-bis(oxidanyl)-2-oxidanylidene-4H-quinazolin-1-yl]propanoic acid

Systemtic Name: 3-[3,4-dimethyl-6,7-bis(oxidanyl)-2-oxidanylidene-4H-quinazolin-1-yl]propanoic acid Openeye Name: 3-(6,7-dihydroxy-3,4-dimethyl-2-oxo-4H-quinazolin-1-yl)propanoic acid CAS Name: 3-(6,7-dihydroxy-3,4-dimethyl-2-oxo-4H-quinazolin-1-yl)propanoic acid IUPAC Name: 3-(6,7-dihydroxy-3,4-dimethyl-2-oxo-4H-quinazolin-1-yl)propanoic acid Traditional Name: 3-(6,7-dihydroxy-2-keto-3,4-dimethyl-4H-quinazolin-1-yl)propionic acid Formula: C13H16N2O5 MolecularWeight: 280.27654

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC(=C(C=C2N(C(=O)N1C)CCC(=O)O)O)O

Isomeric SMILES

CC1C2=CC(=C(C=C2N(C(=O)N1C)CCC(=O)O)O)O

InChI

InChI=1S/C13H16N2O5/c1-7-8-5-10(16)11(17)6-9(8)15(4-3-12(18)19)13(20)14(7)2/h5-7,16-17H,3-4H2,1-2H3,(H,18,19)