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

Systemtic Name: ethyl (E,1Z)-3-bromanyl-N-(4-methylphenyl)sulfonyl-4-oxidanylidene-2-(phenylmethyl)oct-2-enimidate Openeye Name: ethyl (E,1Z)-2-benzyl-3-bromo-4-oxo-N-(p-tolylsulfonyl)oct-2-enimidate CAS Name: (E,1Z)-3-bromo-N-(4-methylphenyl)sulfonyl-4-oxo-2-(phenylmethyl)-2-octenimidic acid ethyl ester IUPAC Name: ethyl (E,1Z)-2-benzyl-3-bromo-N-(4-methylphenyl)sulfonyl-4-oxooct-2-enimidate Traditional Name: (E,1Z)-2-benzyl-3-bromo-4-keto-N-tosyl-oct-2-enimidic acid ethyl ester Formula: C24H28BrNO4S MolecularWeight: 506.45242

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C(=C(CC1=CC=CC=C1)C(=NS(=O)(=O)C2=CC=C(C=C2)C)OCC)Br

Isomeric SMILES

CCCCC(=O)/C(=C(/CC1=CC=CC=C1)\C(=N\S(=O)(=O)C2=CC=C(C=C2)C)\OCC)/Br

InChI

InChI=1S/C24H28BrNO4S/c1-4-6-12-22(27)23(25)21(17-19-10-8-7-9-11-19)24(30-5-2)26-31(28,29)20-15-13-18(3)14-16-20/h7-11,13-16H,4-6,12,17H2,1-3H3/b23-21+,26-24-