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

Systemtic Name: (2E,4E)-5-(4-methylphenyl)sulfonyl-1-piperidin-1-yl-penta-2,4-dien-1-one Openeye Name: (2E,4E)-1-(1-piperidyl)-5-(p-tolylsulfonyl)penta-2,4-dien-1-one CAS Name: (2E,4E)-5-(4-methylphenyl)sulfonyl-1-(1-piperidinyl)-1-penta-2,4-dienone IUPAC Name: (2E,4E)-5-(4-methylphenyl)sulfonyl-1-piperidin-1-ylpenta-2,4-dien-1-one Traditional Name: (2E,4E)-1-piperidino-5-tosyl-penta-2,4-dien-1-one Formula: C17H21NO3S MolecularWeight: 319.41854

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21NO3S/c1-15-8-10-16(11-9-15)22(20,21)14-6-3-7-17(19)18-12-4-2-5-13-18/h3,6-11,14H,2,4-5,12-13H2,1H3/b7-3+,14-6+