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

Systemtic Name: ethyl (E,1Z)-3-bromanyl-2-methyl-N-(4-methylphenyl)sulfonyl-4-oxidanylidene-oct-2-enimidate Openeye Name: ethyl (E,1Z)-3-bromo-2-methyl-4-oxo-N-(p-tolylsulfonyl)oct-2-enimidate CAS Name: (E,1Z)-3-bromo-2-methyl-N-(4-methylphenyl)sulfonyl-4-oxo-2-octenimidic acid ethyl ester IUPAC Name: ethyl (E,1Z)-3-bromo-2-methyl-N-(4-methylphenyl)sulfonyl-4-oxooct-2-enimidate Traditional Name: (E,1Z)-3-bromo-4-keto-2-methyl-N-tosyl-oct-2-enimidic acid ethyl ester Formula: C18H24BrNO4S MolecularWeight: 430.35646

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24BrNO4S/c1-5-7-8-16(21)17(19)14(4)18(24-6-2)20-25(22,23)15-11-9-13(3)10-12-15/h9-12H,5-8H2,1-4H3/b17-14+,20-18-