1-(2H-1,2,3,4-tetrazol-5-yl)isoquinoline-4-carboxylic acid

Systemtic Name: 1-(2H-1,2,3,4-tetrazol-5-yl)isoquinoline-4-carboxylic acid Openeye Name: 1-(2H-tetrazol-5-yl)isoquinoline-4-carboxylic acid CAS Name: 1-(2H-tetrazol-5-yl)-4-isoquinolinecarboxylic acid IUPAC Name: 1-(2H-tetrazol-5-yl)isoquinoline-4-carboxylic acid Traditional Name: 1-(2H-tetrazol-5-yl)isoquinoline-4-carboxylic acid Formula: C11H7N5O2 MolecularWeight: 241.20558

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN=C2C3=NNN=N3)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN=C2C3=NNN=N3)C(=O)O

InChI

InChI=1S/C11H7N5O2/c17-11(18)8-5-12-9(10-13-15-16-14-10)7-4-2-1-3-6(7)8/h1-5H,(H,17,18)(H,13,14,15,16)