ethyl (1Z,2E)-2-(1-bromanyl-2-oxidanylidene-2-phenyl-ethylidene)-N-(4-methylphenyl)sulfonyl-hexanimidate

Systemtic Name: ethyl (1Z,2E)-2-(1-bromanyl-2-oxidanylidene-2-phenyl-ethylidene)-N-(4-methylphenyl)sulfonyl-hexanimidate Openeye Name: ethyl (1Z,2E)-2-(1-bromo-2-oxo-2-phenyl-ethylidene)-N-(p-tolylsulfonyl)hexanimidate CAS Name: (1Z,2E)-2-(1-bromo-2-oxo-2-phenylethylidene)-N-(4-methylphenyl)sulfonylhexanimidic acid ethyl ester IUPAC Name: ethyl (1Z,2E)-2-(1-bromo-2-oxo-2-phenylethylidene)-N-(4-methylphenyl)sulfonylhexanimidate Traditional Name: (E,1Z)-3-bromo-2-butyl-4-keto-4-phenyl-N-tosyl-but-2-enimidic acid ethyl ester Formula: C23H26BrNO4S MolecularWeight: 492.42584

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=C(C(=O)C1=CC=CC=C1)Br)C(=NS(=O)(=O)C2=CC=C(C=C2)C)OCC

Isomeric SMILES

CCCC/C(=C(/C(=O)C1=CC=CC=C1)\Br)/C(=N/S(=O)(=O)C2=CC=C(C=C2)C)/OCC

InChI

InChI=1S/C23H26BrNO4S/c1-4-6-12-20(21(24)22(26)18-10-8-7-9-11-18)23(29-5-2)25-30(27,28)19-15-13-17(3)14-16-19/h7-11,13-16H,4-6,12H2,1-3H3/b21-20+,25-23-