3-[(4-cyanophenyl)carbamoyl]pyrazine-2-carboxylic acid

Systemtic Name: 3-[(4-cyanophenyl)carbamoyl]pyrazine-2-carboxylic acid Openeye Name: 3-[(4-cyanophenyl)carbamoyl]pyrazine-2-carboxylic acid CAS Name: 3-[(4-cyanoanilino)-oxomethyl]-2-pyrazinecarboxylic acid IUPAC Name: 3-[(4-cyanophenyl)carbamoyl]pyrazine-2-carboxylic acid Traditional Name: 3-[(4-cyanophenyl)carbamoyl]pyrazinoic acid Formula: C13H8N4O3 MolecularWeight: 268.22762

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)NC(=O)C2=NC=CN=C2C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C#N)NC(=O)C2=NC=CN=C2C(=O)O

InChI

InChI=1S/C13H8N4O3/c14-7-8-1-3-9(4-2-8)17-12(18)10-11(13(19)20)16-6-5-15-10/h1-6H,(H,17,18)(H,19,20)