ethyl (E)-3-(6-chloranyl-3-nitro-imidazo[1,2-b]pyridazin-2-yl)-2-methyl-prop-2-enoate

Systemtic Name: ethyl (E)-3-(6-chloranyl-3-nitro-imidazo[1,2-b]pyridazin-2-yl)-2-methyl-prop-2-enoate Openeye Name: ethyl (E)-3-(6-chloro-3-nitro-imidazo[1,2-b]pyridazin-2-yl)-2-methyl-prop-2-enoate CAS Name: (E)-3-(6-chloro-3-nitro-2-imidazo[1,2-b]pyridazinyl)-2-methyl-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-(6-chloro-3-nitroimidazo[1,2-b]pyridazin-2-yl)-2-methylprop-2-enoate Traditional Name: (E)-3-(6-chloro-3-nitro-imidazo[1,2-b]pyridazin-2-yl)-2-methyl-acrylic acid ethyl ester Formula: C12H11ClN4O4 MolecularWeight: 310.69314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=C(N2C(=N1)C=CC(=N2)Cl)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)/C(=C/C1=C(N2C(=N1)C=CC(=N2)Cl)[N+](=O)[O-])/C

InChI

InChI=1S/C12H11ClN4O4/c1-3-21-12(18)7(2)6-8-11(17(19)20)16-10(14-8)5-4-9(13)15-16/h4-6H,3H2,1-2H3/b7-6+