3-[[4-[(3-carboxypyrazin-2-yl)carbonylamino]phenyl]carbamoyl]pyrazine-2-carboxylic acid

Systemtic Name: 3-[[4-[(3-carboxypyrazin-2-yl)carbonylamino]phenyl]carbamoyl]pyrazine-2-carboxylic acid Openeye Name: 3-[[4-[(3-carboxypyrazine-2-carbonyl)amino]phenyl]carbamoyl]pyrazine-2-carboxylic acid CAS Name: 3-[[4-[[(3-carboxy-2-pyrazinyl)-oxomethyl]amino]anilino]-oxomethyl]-2-pyrazinecarboxylic acid IUPAC Name: 3-[[4-[(3-carboxypyrazine-2-carbonyl)amino]phenyl]carbamoyl]pyrazine-2-carboxylic acid Traditional Name: 3-[[4-[(3-carboxypyrazinoyl)amino]phenyl]carbamoyl]pyrazinoic acid Formula: C18H12N6O6 MolecularWeight: 408.32448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)C2=NC=CN=C2C(=O)O)NC(=O)C3=NC=CN=C3C(=O)O

Isomeric SMILES

C1=CC(=CC=C1NC(=O)C2=NC=CN=C2C(=O)O)NC(=O)C3=NC=CN=C3C(=O)O

InChI

InChI=1S/C18H12N6O6/c25-15(11-13(17(27)28)21-7-5-19-11)23-9-1-2-10(4-3-9)24-16(26)12-14(18(29)30)22-8-6-20-12/h1-8H,(H,23,25)(H,24,26)(H,27,28)(H,29,30)