4-[3-(4-methoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]-N-(2-methyl-4-nitro-phenyl)butanamide

Systemtic Name: 4-[3-(4-methoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]-N-(2-methyl-4-nitro-phenyl)butanamide Openeye Name: 4-[3-(4-methoxyphenyl)-6-oxo-pyridazin-1-yl]-N-(2-methyl-4-nitro-phenyl)butanamide CAS Name: 4-[3-(4-methoxyphenyl)-6-oxo-1-pyridazinyl]-N-(2-methyl-4-nitrophenyl)butanamide IUPAC Name: 4-[3-(4-methoxyphenyl)-6-oxopyridazin-1-yl]-N-(2-methyl-4-nitrophenyl)butanamide Traditional Name: 4-[6-keto-3-(4-methoxyphenyl)pyridazin-1-yl]-N-(2-methyl-4-nitro-phenyl)butyramide Formula: C22H22N4O5 MolecularWeight: 422.43388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CCCN2C(=O)C=CC(=N2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CCCN2C(=O)C=CC(=N2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H22N4O5/c1-15-14-17(26(29)30)7-10-19(15)23-21(27)4-3-13-25-22(28)12-11-20(24-25)16-5-8-18(31-2)9-6-16/h5-12,14H,3-4,13H2,1-2H3,(H,23,27)