3-heptyl-4-methyl-2-(4-methylphenyl)sulfonyl-1H-pyrrole

Systemtic Name: 3-heptyl-4-methyl-2-(4-methylphenyl)sulfonyl-1H-pyrrole Openeye Name: 3-heptyl-4-methyl-2-(p-tolylsulfonyl)-1H-pyrrole CAS Name: 3-heptyl-4-methyl-2-(4-methylphenyl)sulfonyl-1H-pyrrole IUPAC Name: 3-heptyl-4-methyl-2-(4-methylphenyl)sulfonyl-1H-pyrrole Traditional Name: 3-heptyl-4-methyl-2-tosyl-1H-pyrrole Formula: C19H27NO2S MolecularWeight: 333.48818

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=C(NC=C1C)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCCCCC1=C(NC=C1C)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C19H27NO2S/c1-4-5-6-7-8-9-18-16(3)14-20-19(18)23(21,22)17-12-10-15(2)11-13-17/h10-14,20H,4-9H2,1-3H3