tetraethyl 3-[[3-methylbut-2-enyl-(4-methylphenyl)sulfonyl-amino]methyl]-4-oxidanyl-but-1-ene-1,1,4,4-tetracarboxylate

Systemtic Name: tetraethyl 3-[[3-methylbut-2-enyl-(4-methylphenyl)sulfonyl-amino]methyl]-4-oxidanyl-but-1-ene-1,1,4,4-tetracarboxylate Openeye Name: tetraethyl 4-hydroxy-3-[[3-methylbut-2-enyl(p-tolylsulfonyl)amino]methyl]but-1-ene-1,1,4,4-tetracarboxylate CAS Name: 4-hydroxy-3-[[3-methylbut-2-enyl-(4-methylphenyl)sulfonylamino]methyl]-1-butene-1,1,4,4-tetracarboxylic acid tetraethyl ester IUPAC Name: tetraethyl 4-hydroxy-3-[[3-methylbut-2-enyl-(4-methylphenyl)sulfonylamino]methyl]but-1-ene-1,1,4,4-tetracarboxylate Traditional Name: 4-hydroxy-3-[[3-methylbut-2-enyl(tosyl)amino]methyl]but-1-ene-1,1,4,4-tetracarboxylic acid tetraethyl ester Formula: C29H41NO11S MolecularWeight: 611.70094

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC(CN(CC=C(C)C)S(=O)(=O)C1=CC=C(C=C1)C)C(C(=O)OCC)(C(=O)OCC)O)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CC(CN(CC=C(C)C)S(=O)(=O)C1=CC=C(C=C1)C)C(C(=O)OCC)(C(=O)OCC)O)C(=O)OCC

InChI

InChI=1S/C29H41NO11S/c1-8-38-25(31)24(26(32)39-9-2)18-22(29(35,27(33)40-10-3)28(34)41-11-4)19-30(17-16-20(5)6)42(36,37)23-14-12-21(7)13-15-23/h12-16,18,22,35H,8-11,17,19H2,1-7H3