4-[3-methyl-2,4-bis(oxidanylidene)-1,3-diazinan-1-yl]benzoic acid

Systemtic Name: 4-[3-methyl-2,4-bis(oxidanylidene)-1,3-diazinan-1-yl]benzoic acid Openeye Name: 4-(3-methyl-2,4-dioxo-hexahydropyrimidin-1-yl)benzoic acid CAS Name: 4-(3-methyl-2,4-dioxo-1,3-diazinan-1-yl)benzoic acid IUPAC Name: 4-(3-methyl-2,4-dioxo-1,3-diazinan-1-yl)benzoic acid Traditional Name: 4-(2,4-diketo-3-methyl-hexahydropyrimidin-1-yl)benzoic acid Formula: C12H12N2O4 MolecularWeight: 248.23468

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CCN(C1=O)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CN1C(=O)CCN(C1=O)C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C12H12N2O4/c1-13-10(15)6-7-14(12(13)18)9-4-2-8(3-5-9)11(16)17/h2-5H,6-7H2,1H3,(H,16,17)