3-[6-chloranyl-1-(4-methylphenyl)sulfonyl-hexyl]-2H-indazole

Systemtic Name: 3-[6-chloranyl-1-(4-methylphenyl)sulfonyl-hexyl]-2H-indazole Openeye Name: 3-[6-chloro-1-(p-tolylsulfonyl)hexyl]-2H-indazole CAS Name: 3-[6-chloro-1-(4-methylphenyl)sulfonylhexyl]-2H-indazole IUPAC Name: 3-[6-chloro-1-(4-methylphenyl)sulfonylhexyl]-2H-indazole Traditional Name: 3-(6-chloro-1-tosyl-hexyl)-2H-indazole Formula: C20H23ClN2O2S MolecularWeight: 390.92682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(CCCCCCl)C2=C3C=CC=CC3=NN2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(CCCCCCl)C2=C3C=CC=CC3=NN2

InChI

InChI=1S/C20H23ClN2O2S/c1-15-10-12-16(13-11-15)26(24,25)19(9-3-2-6-14-21)20-17-7-4-5-8-18(17)22-23-20/h4-5,7-8,10-13,19H,2-3,6,9,14H2,1H3,(H,22,23)