2-[[4-methyl-3,5-bis(oxidanylidene)-1,2,4-triazolidin-1-yl]methyl]benzoic acid

Systemtic Name: 2-[[4-methyl-3,5-bis(oxidanylidene)-1,2,4-triazolidin-1-yl]methyl]benzoic acid Openeye Name: 2-[(4-methyl-3,5-dioxo-1,2,4-triazolidin-1-yl)methyl]benzoic acid CAS Name: 2-[(4-methyl-3,5-dioxo-1,2,4-triazolidin-1-yl)methyl]benzoic acid IUPAC Name: 2-[(4-methyl-3,5-dioxo-1,2,4-triazolidin-1-yl)methyl]benzoic acid Traditional Name: 2-[(3,5-diketo-4-methyl-1,2,4-triazolidin-1-yl)methyl]benzoic acid Formula: C11H11N3O4 MolecularWeight: 249.22274

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)NN(C1=O)CC2=CC=CC=C2C(=O)O

Isomeric SMILES

CN1C(=O)NN(C1=O)CC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C11H11N3O4/c1-13-10(17)12-14(11(13)18)6-7-4-2-3-5-8(7)9(15)16/h2-5H,6H2,1H3,(H,12,17)(H,15,16)