1-[(3-chlorophenyl)methyl]-1,2,3-triazole-4,5-dicarboxylic acid

Systemtic Name: 1-[(3-chlorophenyl)methyl]-1,2,3-triazole-4,5-dicarboxylic acid Openeye Name: 1-[(3-chlorophenyl)methyl]triazole-4,5-dicarboxylic acid CAS Name: 1-[(3-chlorophenyl)methyl]triazole-4,5-dicarboxylic acid IUPAC Name: 1-[(3-chlorophenyl)methyl]triazole-4,5-dicarboxylic acid Traditional Name: 1-(3-chlorobenzyl)triazole-4,5-dicarboxylic acid Formula: C11H8ClN3O4 MolecularWeight: 281.65192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)CN2C(=C(N=N2)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)CN2C(=C(N=N2)C(=O)O)C(=O)O

InChI

InChI=1S/C11H8ClN3O4/c12-7-3-1-2-6(4-7)5-15-9(11(18)19)8(10(16)17)13-14-15/h1-4H,5H2,(H,16,17)(H,18,19)