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

Systemtic Name: ethyl (E,1Z)-3-bromanyl-N-(4-methylphenyl)sulfonyl-4-oxidanylidene-2-(phenylmethyl)hex-2-enimidate Openeye Name: ethyl (E,1Z)-2-benzyl-3-bromo-4-oxo-N-(p-tolylsulfonyl)hex-2-enimidate CAS Name: (E,1Z)-3-bromo-N-(4-methylphenyl)sulfonyl-4-oxo-2-(phenylmethyl)-2-hexenimidic acid ethyl ester IUPAC Name: ethyl (E,1Z)-2-benzyl-3-bromo-N-(4-methylphenyl)sulfonyl-4-oxohex-2-enimidate Traditional Name: (E,1Z)-2-benzyl-3-bromo-4-keto-N-tosyl-hex-2-enimidic acid ethyl ester Formula: C22H24BrNO4S MolecularWeight: 478.39926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24BrNO4S/c1-4-20(25)21(23)19(15-17-9-7-6-8-10-17)22(28-5-2)24-29(26,27)18-13-11-16(3)12-14-18/h6-14H,4-5,15H2,1-3H3/b21-19+,24-22-