diethyl (2Z,4Z)-2,5-dicyano-3,4-bis[(4-methylphenyl)sulfonylamino]hexa-2,4-dienedioate

Systemtic Name: diethyl (2Z,4Z)-2,5-dicyano-3,4-bis[(4-methylphenyl)sulfonylamino]hexa-2,4-dienedioate Openeye Name: diethyl (2Z,4Z)-2,5-dicyano-3,4-bis(p-tolylsulfonylamino)hexa-2,4-dienedioate CAS Name: (2Z,4Z)-2,5-dicyano-3,4-bis[(4-methylphenyl)sulfonylamino]hexa-2,4-dienedioic acid diethyl ester IUPAC Name: diethyl (2Z,4Z)-2,5-dicyano-3,4-bis[(4-methylphenyl)sulfonylamino]hexa-2,4-dienedioate Traditional Name: (2Z,4Z)-2,5-dicyano-3,4-bis(tosylamino)muconic acid diethyl ester Formula: C26H26N4O8S2 MolecularWeight: 586.63664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(C(=C(C#N)C(=O)OCC)NS(=O)(=O)C1=CC=C(C=C1)C)NS(=O)(=O)C2=CC=C(C=C2)C)C#N

Isomeric SMILES

CCOC(=O)/C(=C(\NS(=O)(=O)C1=CC=C(C=C1)C)/C(=C(/C(=O)OCC)\C#N)/NS(=O)(=O)C2=CC=C(C=C2)C)/C#N

InChI

InChI=1S/C26H26N4O8S2/c1-5-37-25(31)21(15-27)23(29-39(33,34)19-11-7-17(3)8-12-19)24(22(16-28)26(32)38-6-2)30-40(35,36)20-13-9-18(4)10-14-20/h7-14,29-30H,5-6H2,1-4H3/b23-21-,24-22-