(2Z,4E)-2,5-bis-(4-methylphenyl)sulfonyl-1-piperidin-1-yl-penta-2,4-dien-1-one

Systemtic Name: (2Z,4E)-2,5-bis-(4-methylphenyl)sulfonyl-1-piperidin-1-yl-penta-2,4-dien-1-one Openeye Name: (2Z,4E)-1-(1-piperidyl)-2,5-bis(p-tolylsulfonyl)penta-2,4-dien-1-one CAS Name: (2Z,4E)-2,5-bis-(4-methylphenyl)sulfonyl-1-(1-piperidinyl)-1-penta-2,4-dienone IUPAC Name: (2Z,4E)-2,5-bis-(4-methylphenyl)sulfonyl-1-piperidin-1-ylpenta-2,4-dien-1-one Traditional Name: (2Z,4E)-1-piperidino-2,5-ditosyl-penta-2,4-dien-1-one Formula: C24H27NO5S2 MolecularWeight: 473.60488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C=CC=C(C(=O)N2CCCCC2)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/C=C/C=C(/C(=O)N2CCCCC2)\S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C24H27NO5S2/c1-19-8-12-21(13-9-19)31(27,28)18-6-7-23(24(26)25-16-4-3-5-17-25)32(29,30)22-14-10-20(2)11-15-22/h6-15,18H,3-5,16-17H2,1-2H3/b18-6+,23-7-