4-(7-chloranyl-1-methyl-4-oxidanylidene-pyridazino[3,4-b]quinoxalin-3-yl)butanoic acid

Systemtic Name: 4-(7-chloranyl-1-methyl-4-oxidanylidene-pyridazino[3,4-b]quinoxalin-3-yl)butanoic acid Openeye Name: 4-(7-chloro-1-methyl-4-oxo-pyridazino[3,4-b]quinoxalin-3-yl)butanoic acid CAS Name: 4-(7-chloro-1-methyl-4-oxo-3-pyridazino[3,4-b]quinoxalinyl)butanoic acid IUPAC Name: 4-(7-chloro-1-methyl-4-oxopyridazino[3,4-b]quinoxalin-3-yl)butanoic acid Traditional Name: 4-(7-chloro-4-keto-1-methyl-pyridazino[3,4-b]quinoxalin-3-yl)butyric acid Formula: C15H13ClN4O3 MolecularWeight: 332.74172

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=NC3=C(C=C(C=C3)Cl)N=C2C(=O)C(=N1)CCCC(=O)O

Isomeric SMILES

CN1C2=NC3=C(C=C(C=C3)Cl)N=C2C(=O)C(=N1)CCCC(=O)O

InChI

InChI=1S/C15H13ClN4O3/c1-20-15-13(14(23)10(19-20)3-2-4-12(21)22)17-11-7-8(16)5-6-9(11)18-15/h5-7H,2-4H2,1H3,(H,21,22)