4-[2-(5-chloranyl-2-oxidanylidene-indol-3-yl)hydrazinyl]-N-(2,4-dimethylphenyl)-3-nitro-benzenesulfonamide

Systemtic Name: 4-[2-(5-chloranyl-2-oxidanylidene-indol-3-yl)hydrazinyl]-N-(2,4-dimethylphenyl)-3-nitro-benzenesulfonamide Openeye Name: 4-[2-(5-chloro-2-oxo-indol-3-yl)hydrazino]-N-(2,4-dimethylphenyl)-3-nitro-benzenesulfonamide CAS Name: 4-[(5-chloro-2-oxo-3-indolyl)hydrazo]-N-(2,4-dimethylphenyl)-3-nitrobenzenesulfonamide IUPAC Name: 4-[2-(5-chloro-2-oxoindol-3-yl)hydrazinyl]-N-(2,4-dimethylphenyl)-3-nitrobenzenesulfonamide Traditional Name: 4-[N'-(5-chloro-2-keto-indol-3-yl)hydrazino]-N-(2,4-dimethylphenyl)-3-nitro-benzenesulfonamide Formula: C22H18ClN5O5S MolecularWeight: 499.92682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)NNC3=C4C=C(C=CC4=NC3=O)Cl)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)NNC3=C4C=C(C=CC4=NC3=O)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C22H18ClN5O5S/c1-12-3-6-17(13(2)9-12)27-34(32,33)15-5-8-19(20(11-15)28(30)31)25-26-21-16-10-14(23)4-7-18(16)24-22(21)29/h3-11,25,27H,1-2H3,(H,24,26,29)