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

Systemtic Name: ethyl (E,1Z)-3-bromanyl-N-(4-methylphenyl)sulfonyl-4-oxidanylidene-4-phenyl-but-2-enimidate Openeye Name: ethyl (E,1Z)-3-bromo-4-oxo-4-phenyl-N-(p-tolylsulfonyl)but-2-enimidate CAS Name: (E,1Z)-3-bromo-N-(4-methylphenyl)sulfonyl-4-oxo-4-phenyl-2-butenimidic acid ethyl ester IUPAC Name: ethyl (E,1Z)-3-bromo-N-(4-methylphenyl)sulfonyl-4-oxo-4-phenylbut-2-enimidate Traditional Name: (E,1Z)-3-bromo-4-keto-4-phenyl-N-tosyl-but-2-enimidic acid ethyl ester Formula: C19H18BrNO4S MolecularWeight: 436.31952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=NS(=O)(=O)C1=CC=C(C=C1)C)C=C(C(=O)C2=CC=CC=C2)Br

Isomeric SMILES

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

InChI

InChI=1S/C19H18BrNO4S/c1-3-25-18(13-17(20)19(22)15-7-5-4-6-8-15)21-26(23,24)16-11-9-14(2)10-12-16/h4-13H,3H2,1-2H3/b17-13+,21-18-