(E)-5-(4-methylphenyl)sulfonyl-1-pyridin-3-yl-pent-1-en-3-one

Systemtic Name: (E)-5-(4-methylphenyl)sulfonyl-1-pyridin-3-yl-pent-1-en-3-one Openeye Name: (E)-5-(p-tolylsulfonyl)-1-(3-pyridyl)pent-1-en-3-one CAS Name: (E)-5-(4-methylphenyl)sulfonyl-1-(3-pyridinyl)-1-penten-3-one IUPAC Name: (E)-5-(4-methylphenyl)sulfonyl-1-pyridin-3-ylpent-1-en-3-one Traditional Name: (E)-1-(3-pyridyl)-5-tosyl-pent-1-en-3-one Formula: C17H17NO3S MolecularWeight: 315.38678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)C=CC2=CN=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)/C=C/C2=CN=CC=C2

InChI

InChI=1S/C17H17NO3S/c1-14-4-8-17(9-5-14)22(20,21)12-10-16(19)7-6-15-3-2-11-18-13-15/h2-9,11,13H,10,12H2,1H3/b7-6+