1-[3-chloranyl-1-(4-methylphenyl)sulfonyl-pyrrol-2-yl]ethanone

Systemtic Name: 1-[3-chloranyl-1-(4-methylphenyl)sulfonyl-pyrrol-2-yl]ethanone Openeye Name: 1-[3-chloro-1-(p-tolylsulfonyl)pyrrol-2-yl]ethanone CAS Name: 1-[3-chloro-1-(4-methylphenyl)sulfonyl-2-pyrrolyl]ethanone IUPAC Name: 1-[3-chloro-1-(4-methylphenyl)sulfonylpyrrol-2-yl]ethanone Traditional Name: 1-(3-chloro-1-tosyl-pyrrol-2-yl)ethanone Formula: C13H12ClNO3S MolecularWeight: 297.75728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC(=C2C(=O)C)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC(=C2C(=O)C)Cl

InChI

InChI=1S/C13H12ClNO3S/c1-9-3-5-11(6-4-9)19(17,18)15-8-7-12(14)13(15)10(2)16/h3-8H,1-2H3