6-[bis(cyanomethyl)carbamoyl]pyridine-2-carboxylic acid

Systemtic Name: 6-[bis(cyanomethyl)carbamoyl]pyridine-2-carboxylic acid Openeye Name: 6-[bis(cyanomethyl)carbamoyl]pyridine-2-carboxylic acid CAS Name: 6-[[bis(cyanomethyl)amino]-oxomethyl]-2-pyridinecarboxylic acid IUPAC Name: 6-[bis(cyanomethyl)carbamoyl]pyridine-2-carboxylic acid Traditional Name: 6-[bis(cyanomethyl)carbamoyl]picolinic acid Formula: C11H8N4O3 MolecularWeight: 244.20622

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC(=C1)C(=O)O)C(=O)N(CC#N)CC#N

Isomeric SMILES

C1=CC(=NC(=C1)C(=O)O)C(=O)N(CC#N)CC#N

InChI

InChI=1S/C11H8N4O3/c12-4-6-15(7-5-13)10(16)8-2-1-3-9(14-8)11(17)18/h1-3H,6-7H2,(H,17,18)