5-(1,2,4-triazol-4-yl)benzene-1,3-dicarboxylic acid

Systemtic Name: 5-(1,2,4-triazol-4-yl)benzene-1,3-dicarboxylic acid Openeye Name: 5-(1,2,4-triazol-4-yl)benzene-1,3-dicarboxylic acid CAS Name: 5-(1,2,4-triazol-4-yl)benzene-1,3-dicarboxylic acid IUPAC Name: 5-(1,2,4-triazol-4-yl)benzene-1,3-dicarboxylic acid Traditional Name: 5-(1,2,4-triazol-4-yl)isophthalic acid Formula: C10H7N3O4 MolecularWeight: 233.18028

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C(=O)O)N2C=NN=C2)C(=O)O

Isomeric SMILES

C1=C(C=C(C=C1C(=O)O)N2C=NN=C2)C(=O)O

InChI

InChI=1S/C10H7N3O4/c14-9(15)6-1-7(10(16)17)3-8(2-6)13-4-11-12-5-13/h1-5H,(H,14,15)(H,16,17)