1-(thiophen-2-ylmethyl)benzotriazole-5-carboxylic acid

Systemtic Name: 1-(thiophen-2-ylmethyl)benzotriazole-5-carboxylic acid Openeye Name: 1-(2-thienylmethyl)benzotriazole-5-carboxylic acid CAS Name: 1-(thiophen-2-ylmethyl)-5-benzotriazolecarboxylic acid IUPAC Name: 1-(thiophen-2-ylmethyl)benzotriazole-5-carboxylic acid Traditional Name: 1-(2-thenyl)benzotriazole-5-carboxylic acid Formula: C12H9N3O2S MolecularWeight: 259.28376

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CN2C3=C(C=C(C=C3)C(=O)O)N=N2

Isomeric SMILES

C1=CSC(=C1)CN2C3=C(C=C(C=C3)C(=O)O)N=N2

InChI

InChI=1S/C12H9N3O2S/c16-12(17)8-3-4-11-10(6-8)13-14-15(11)7-9-2-1-5-18-9/h1-6H,7H2,(H,16,17)