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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CCNS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CCNS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

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