methyl 4-[(E)-2-[1-(4-methylphenyl)sulfonyl-6-oxidanylidene-piperidin-2-yl]ethenyl]benzoate

Systemtic Name: methyl 4-[(E)-2-[1-(4-methylphenyl)sulfonyl-6-oxidanylidene-piperidin-2-yl]ethenyl]benzoate Openeye Name: methyl 4-[(E)-2-[6-oxo-1-(p-tolylsulfonyl)-2-piperidyl]vinyl]benzoate CAS Name: 4-[(E)-2-[1-(4-methylphenyl)sulfonyl-6-oxo-2-piperidinyl]ethenyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-2-[1-(4-methylphenyl)sulfonyl-6-oxopiperidin-2-yl]ethenyl]benzoate Traditional Name: 4-[(E)-2-(6-keto-1-tosyl-2-piperidyl)vinyl]benzoic acid methyl ester Formula: C22H23NO5S MolecularWeight: 413.48672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(CCCC2=O)C=CC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(CCCC2=O)/C=C/C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H23NO5S/c1-16-6-14-20(15-7-16)29(26,27)23-19(4-3-5-21(23)24)13-10-17-8-11-18(12-9-17)22(25)28-2/h6-15,19H,3-5H2,1-2H3/b13-10+