1-(3,6-dihydro-2H-pyridin-1-ylcarbonyl)benzotriazole-5-carboxylic acid

Systemtic Name: 1-(3,6-dihydro-2H-pyridin-1-ylcarbonyl)benzotriazole-5-carboxylic acid Openeye Name: 1-(3,6-dihydro-2H-pyridine-1-carbonyl)benzotriazole-5-carboxylic acid CAS Name: 1-[3,6-dihydro-2H-pyridin-1-yl(oxo)methyl]-5-benzotriazolecarboxylic acid IUPAC Name: 1-(3,6-dihydro-2H-pyridine-1-carbonyl)benzotriazole-5-carboxylic acid Traditional Name: 1-(3,6-dihydro-2H-pyridine-1-carbonyl)benzotriazole-5-carboxylic acid Formula: C13H12N4O3 MolecularWeight: 272.25938

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC=C1)C(=O)N2C3=C(C=C(C=C3)C(=O)O)N=N2

Isomeric SMILES

C1CN(CC=C1)C(=O)N2C3=C(C=C(C=C3)C(=O)O)N=N2

InChI

InChI=1S/C13H12N4O3/c18-12(19)9-4-5-11-10(8-9)14-15-17(11)13(20)16-6-2-1-3-7-16/h1-2,4-5,8H,3,6-7H2,(H,18,19)