ethyl (E,1Z)-3-bromanyl-2-methyl-N-(4-methylphenyl)sulfonyl-4-oxidanylidene-hex-2-enimidate

Systemtic Name: ethyl (E,1Z)-3-bromanyl-2-methyl-N-(4-methylphenyl)sulfonyl-4-oxidanylidene-hex-2-enimidate Openeye Name: ethyl (E,1Z)-3-bromo-2-methyl-4-oxo-N-(p-tolylsulfonyl)hex-2-enimidate CAS Name: (E,1Z)-3-bromo-2-methyl-N-(4-methylphenyl)sulfonyl-4-oxo-2-hexenimidic acid ethyl ester IUPAC Name: ethyl (E,1Z)-3-bromo-2-methyl-N-(4-methylphenyl)sulfonyl-4-oxohex-2-enimidate Traditional Name: (E,1Z)-3-bromo-4-keto-2-methyl-N-tosyl-hex-2-enimidic acid ethyl ester Formula: C16H20BrNO4S MolecularWeight: 402.3033

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(=C(C)C(=NS(=O)(=O)C1=CC=C(C=C1)C)OCC)Br

Isomeric SMILES

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

InChI

InChI=1S/C16H20BrNO4S/c1-5-14(19)15(17)12(4)16(22-6-2)18-23(20,21)13-9-7-11(3)8-10-13/h7-10H,5-6H2,1-4H3/b15-12+,18-16-