4-butyl-7-chloranyl-6-imidazol-1-yl-1H-quinoxaline-2,3-dione sulfate

Systemtic Name: 4-butyl-7-chloranyl-6-imidazol-1-yl-1H-quinoxaline-2,3-dione sulfate Openeye Name: 4-butyl-7-chloro-6-imidazol-1-yl-1H-quinoxaline-2,3-dione sulfate CAS Name: 4-butyl-7-chloro-6-(1-imidazolyl)-1H-quinoxaline-2,3-dione sulfate IUPAC Name: 4-butyl-7-chloro-6-imidazol-1-yl-1H-quinoxaline-2,3-dione sulfate Traditional Name: 4-butyl-7-chloro-6-imidazol-1-yl-1H-quinoxaline-2,3-quinone sulfate Formula: C15H15ClN4O6S-2 MolecularWeight: 414.8208

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC(=C(C=C2NC(=O)C1=O)Cl)N3C=CN=C3.[O-]S(=O)(=O)[O-]

Isomeric SMILES

CCCCN1C2=CC(=C(C=C2NC(=O)C1=O)Cl)N3C=CN=C3.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C15H15ClN4O2.H2O4S/c1-2-3-5-20-13-8-12(19-6-4-17-9-19)10(16)7-11(13)18-14(21)15(20)22;1-5(2,3)4/h4,6-9H,2-3,5H2,1H3,(H,18,21);(H2,1,2,3,4)/p-2