4-(7-chloranyl-1-methyl-4-nitroso-2H-pyridazino[3,4-b]quinoxalin-3-yl)butanoic acid

Systemtic Name: 4-(7-chloranyl-1-methyl-4-nitroso-2H-pyridazino[3,4-b]quinoxalin-3-yl)butanoic acid Openeye Name: 4-(7-chloro-1-methyl-4-nitroso-2H-pyridazino[3,4-b]quinoxalin-3-yl)butanoic acid CAS Name: 4-(7-chloro-1-methyl-4-nitroso-2H-pyridazino[3,4-b]quinoxalin-3-yl)butanoic acid IUPAC Name: 4-(7-chloro-1-methyl-4-nitroso-2H-pyridazino[3,4-b]quinoxalin-3-yl)butanoic acid Traditional Name: 4-(7-chloro-1-methyl-4-nitroso-2H-pyridazino[3,4-b]quinoxalin-3-yl)butyric acid Formula: C15H14ClN5O3 MolecularWeight: 347.75636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14ClN5O3/c1-21-15-14(17-11-7-8(16)5-6-9(11)18-15)13(20-24)10(19-21)3-2-4-12(22)23/h5-7,19H,2-4H2,1H3,(H,22,23)