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

Systemtic Name: N-[2-[3-(4-methoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]ethyl]-4-methyl-3,5-dinitro-benzenesulfonamide Openeye Name: N-[2-[3-(4-methoxyphenyl)-6-oxo-pyridazin-1-yl]ethyl]-4-methyl-3,5-dinitro-benzenesulfonamide CAS Name: N-[2-[3-(4-methoxyphenyl)-6-oxo-1-pyridazinyl]ethyl]-4-methyl-3,5-dinitrobenzenesulfonamide IUPAC Name: N-[2-[3-(4-methoxyphenyl)-6-oxopyridazin-1-yl]ethyl]-4-methyl-3,5-dinitrobenzenesulfonamide Traditional Name: N-[2-[6-keto-3-(4-methoxyphenyl)pyridazin-1-yl]ethyl]-4-methyl-3,5-dinitro-benzenesulfonamide Formula: C20H19N5O8S MolecularWeight: 489.45856

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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)[N+](=O)[O-]

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)[N+](=O)[O-]

InChI

InChI=1S/C20H19N5O8S/c1-13-18(24(27)28)11-16(12-19(13)25(29)30)34(31,32)21-9-10-23-20(26)8-7-17(22-23)14-3-5-15(33-2)6-4-14/h3-8,11-12,21H,9-10H2,1-2H3