sodium 2-chloranyl-6-(quinoxalin-6-ylcarbonylcarbamoylamino)benzoate

Systemtic Name: sodium 2-chloranyl-6-(quinoxalin-6-ylcarbonylcarbamoylamino)benzoate Openeye Name: sodium 2-chloro-6-(quinoxaline-6-carbonylcarbamoylamino)benzoate CAS Name: sodium 2-chloro-6-[[oxo-[[oxo(6-quinoxalinyl)methyl]amino]methyl]amino]benzoate IUPAC Name: sodium 2-chloro-6-(quinoxaline-6-carbonylcarbamoylamino)benzoate Traditional Name: sodium 2-chloro-6-(quinoxaline-6-carbonylcarbamoylamino)benzoate Formula: C17H10ClN4NaO4 MolecularWeight: 392.72847

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)C(=O)[O-])NC(=O)NC(=O)C2=CC3=NC=CN=C3C=C2.[Na+]

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)C(=O)[O-])NC(=O)NC(=O)C2=CC3=NC=CN=C3C=C2.[Na+]

InChI

InChI=1S/C17H11ClN4O4.Na/c18-10-2-1-3-12(14(10)16(24)25)21-17(26)22-15(23)9-4-5-11-13(8-9)20-7-6-19-11;/h1-8H,(H,24,25)(H2,21,22,23,26);/q;+1/p-1