5-cyclopropyl-1-isoquinolin-5-yl-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 5-cyclopropyl-1-isoquinolin-5-yl-1,2,3-triazole-4-carboxylic acid Openeye Name: 5-cyclopropyl-1-(5-isoquinolyl)triazole-4-carboxylic acid CAS Name: 5-cyclopropyl-1-(5-isoquinolinyl)-4-triazolecarboxylic acid IUPAC Name: 5-cyclopropyl-1-isoquinolin-5-yltriazole-4-carboxylic acid Traditional Name: 5-cyclopropyl-1-(5-isoquinolyl)triazole-4-carboxylic acid Formula: C15H12N4O2 MolecularWeight: 280.28138

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=C(N=NN2C3=CC=CC4=C3C=CN=C4)C(=O)O

Isomeric SMILES

C1CC1C2=C(N=NN2C3=CC=CC4=C3C=CN=C4)C(=O)O

InChI

InChI=1S/C15H12N4O2/c20-15(21)13-14(9-4-5-9)19(18-17-13)12-3-1-2-10-8-16-7-6-11(10)12/h1-3,6-9H,4-5H2,(H,20,21)