N-[3-chloranyl-4-(2-methylpropoxy)phenyl]-6-methyl-1-(2-nitrophenyl)-4-oxidanylidene-pyridazine-3-carboxamide

Systemtic Name: N-[3-chloranyl-4-(2-methylpropoxy)phenyl]-6-methyl-1-(2-nitrophenyl)-4-oxidanylidene-pyridazine-3-carboxamide Openeye Name: N-(3-chloro-4-isobutoxy-phenyl)-6-methyl-1-(2-nitrophenyl)-4-oxo-pyridazine-3-carboxamide CAS Name: N-[3-chloro-4-(2-methylpropoxy)phenyl]-6-methyl-1-(2-nitrophenyl)-4-oxo-3-pyridazinecarboxamide IUPAC Name: N-[3-chloro-4-(2-methylpropoxy)phenyl]-6-methyl-1-(2-nitrophenyl)-4-oxopyridazine-3-carboxamide Traditional Name: N-(3-chloro-4-isobutoxy-phenyl)-4-keto-6-methyl-1-(2-nitrophenyl)pyridazine-3-carboxamide Formula: C22H21ClN4O5 MolecularWeight: 456.87894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC=C2[N+](=O)[O-])C(=O)NC3=CC(=C(C=C3)OCC(C)C)Cl

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC=C2[N+](=O)[O-])C(=O)NC3=CC(=C(C=C3)OCC(C)C)Cl

InChI

InChI=1S/C22H21ClN4O5/c1-13(2)12-32-20-9-8-15(11-16(20)23)24-22(29)21-19(28)10-14(3)26(25-21)17-6-4-5-7-18(17)27(30)31/h4-11,13H,12H2,1-3H3,(H,24,29)