1-cyanoisoquinoline-4-carboxylic acid

Systemtic Name: 1-cyanoisoquinoline-4-carboxylic acid Openeye Name: 1-cyanoisoquinoline-4-carboxylic acid CAS Name: 1-cyano-4-isoquinolinecarboxylic acid IUPAC Name: 1-cyanoisoquinoline-4-carboxylic acid Traditional Name: 1-cyanoisoquinoline-4-carboxylic acid Formula: C11H6N2O2 MolecularWeight: 198.17754

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN=C2C#N)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN=C2C#N)C(=O)O

InChI

InChI=1S/C11H6N2O2/c12-5-10-8-4-2-1-3-7(8)9(6-13-10)11(14)15/h1-4,6H,(H,14,15)