3-[4,5-dimethyl-6-oxidanyl-2,7-bis(oxidanylidene)-3H-quinazolin-1-yl]propanoic acid

Systemtic Name: 3-[4,5-dimethyl-6-oxidanyl-2,7-bis(oxidanylidene)-3H-quinazolin-1-yl]propanoic acid Openeye Name: 3-(6-hydroxy-4,5-dimethyl-2,7-dioxo-3H-quinazolin-1-yl)propanoic acid CAS Name: 3-(6-hydroxy-4,5-dimethyl-2,7-dioxo-3H-quinazolin-1-yl)propanoic acid IUPAC Name: 3-(6-hydroxy-4,5-dimethyl-2,7-dioxo-3H-quinazolin-1-yl)propanoic acid Traditional Name: 3-(6-hydroxy-2,7-diketo-4,5-dimethyl-3H-quinazolin-1-yl)propionic acid Formula: C13H14N2O5 MolecularWeight: 278.26066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C=C2C1=C(NC(=O)N2CCC(=O)O)C)O

Isomeric SMILES

CC1=C(C(=O)C=C2C1=C(NC(=O)N2CCC(=O)O)C)O

InChI

InChI=1S/C13H14N2O5/c1-6-11-7(2)14-13(20)15(4-3-10(17)18)8(11)5-9(16)12(6)19/h5,19H,3-4H2,1-2H3,(H,14,20)(H,17,18)