(E)-1-[2-methyl-1-(4-methylphenyl)sulfonyl-2,3-dihydropyrrol-5-yl]but-2-en-1-one

Systemtic Name: (E)-1-[2-methyl-1-(4-methylphenyl)sulfonyl-2,3-dihydropyrrol-5-yl]but-2-en-1-one Openeye Name: (E)-1-[2-methyl-1-(p-tolylsulfonyl)-2,3-dihydropyrrol-5-yl]but-2-en-1-one CAS Name: (E)-1-[2-methyl-1-(4-methylphenyl)sulfonyl-2,3-dihydropyrrol-5-yl]-2-buten-1-one IUPAC Name: (E)-1-[2-methyl-1-(4-methylphenyl)sulfonyl-2,3-dihydropyrrol-5-yl]but-2-en-1-one Traditional Name: (E)-1-(5-methyl-1-tosyl-2-pyrrolin-2-yl)but-2-en-1-one Formula: C16H19NO3S MolecularWeight: 305.39196

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)C1=CCC(N1S(=O)(=O)C2=CC=C(C=C2)C)C

Isomeric SMILES

C/C=C/C(=O)C1=CCC(N1S(=O)(=O)C2=CC=C(C=C2)C)C

InChI

InChI=1S/C16H19NO3S/c1-4-5-16(18)15-11-8-13(3)17(15)21(19,20)14-9-6-12(2)7-10-14/h4-7,9-11,13H,8H2,1-3H3/b5-4+