N-[2-[3-(4-methoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]ethyl]-2-methyl-5-nitro-benzenesulfonamide

Systemtic Name: N-[2-[3-(4-methoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]ethyl]-2-methyl-5-nitro-benzenesulfonamide Openeye Name: N-[2-[3-(4-methoxyphenyl)-6-oxo-pyridazin-1-yl]ethyl]-2-methyl-5-nitro-benzenesulfonamide CAS Name: N-[2-[3-(4-methoxyphenyl)-6-oxo-1-pyridazinyl]ethyl]-2-methyl-5-nitrobenzenesulfonamide IUPAC Name: N-[2-[3-(4-methoxyphenyl)-6-oxopyridazin-1-yl]ethyl]-2-methyl-5-nitrobenzenesulfonamide Traditional Name: N-[2-[6-keto-3-(4-methoxyphenyl)pyridazin-1-yl]ethyl]-2-methyl-5-nitro-benzenesulfonamide Formula: C20H20N4O6S MolecularWeight: 444.461

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCCN2C(=O)C=CC(=N2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCCN2C(=O)C=CC(=N2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H20N4O6S/c1-14-3-6-16(24(26)27)13-19(14)31(28,29)21-11-12-23-20(25)10-9-18(22-23)15-4-7-17(30-2)8-5-15/h3-10,13,21H,11-12H2,1-2H3