ethyl (1E)-N-(4-methylphenyl)sulfonyl-2-[4-(4-oxidanylidenepiperidin-1-yl)phenyl]ethanehydrazonate

Systemtic Name: ethyl (1E)-N-(4-methylphenyl)sulfonyl-2-[4-(4-oxidanylidenepiperidin-1-yl)phenyl]ethanehydrazonate Openeye Name: ethyl (1E)-2-[4-(4-oxo-1-piperidyl)phenyl]-N-(p-tolylsulfonyl)ethanehydrazonate CAS Name: (1E)-N-(4-methylphenyl)sulfonyl-2-[4-(4-oxo-1-piperidinyl)phenyl]ethanehydrazonic acid ethyl ester IUPAC Name: ethyl (1E)-N-(4-methylphenyl)sulfonyl-2-[4-(4-oxopiperidin-1-yl)phenyl]ethanehydrazonate Traditional Name: (1E)-2-[4-(4-ketopiperidino)phenyl]-N-tosyl-acetohydrazonic acid ethyl ester Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=NNS(=O)(=O)C1=CC=C(C=C1)C)CC2=CC=C(C=C2)N3CCC(=O)CC3

Isomeric SMILES

CCO/C(=N/NS(=O)(=O)C1=CC=C(C=C1)C)/CC2=CC=C(C=C2)N3CCC(=O)CC3

InChI

InChI=1S/C22H27N3O4S/c1-3-29-22(23-24-30(27,28)21-10-4-17(2)5-11-21)16-18-6-8-19(9-7-18)25-14-12-20(26)13-15-25/h4-11,24H,3,12-16H2,1-2H3/b23-22+