4-methyl-N-[3-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]-3,5-dinitro-benzenesulfonamide

Systemtic Name: 4-methyl-N-[3-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]-3,5-dinitro-benzenesulfonamide Openeye Name: 4-methyl-N-[3-[6-(4-methyl-1-piperidyl)pyridazin-3-yl]phenyl]-3,5-dinitro-benzenesulfonamide CAS Name: 4-methyl-N-[3-[6-(4-methyl-1-piperidinyl)-3-pyridazinyl]phenyl]-3,5-dinitrobenzenesulfonamide IUPAC Name: 4-methyl-N-[3-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]-3,5-dinitrobenzenesulfonamide Traditional Name: 4-methyl-N-[3-[6-(4-methylpiperidino)pyridazin-3-yl]phenyl]-3,5-dinitro-benzenesulfonamide Formula: C23H24N6O6S MolecularWeight: 512.53826

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=NN=C(C=C2)C3=CC(=CC=C3)NS(=O)(=O)C4=CC(=C(C(=C4)[N+](=O)[O-])C)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=NN=C(C=C2)C3=CC(=CC=C3)NS(=O)(=O)C4=CC(=C(C(=C4)[N+](=O)[O-])C)[N+](=O)[O-]

InChI

InChI=1S/C23H24N6O6S/c1-15-8-10-27(11-9-15)23-7-6-20(24-25-23)17-4-3-5-18(12-17)26-36(34,35)19-13-21(28(30)31)16(2)22(14-19)29(32)33/h3-7,12-15,26H,8-11H2,1-2H3