bis[4-methyl-2-oxidanylidene-6-[(E)-2-phenylethenyl]pyridin-1-yl] butane-1,4-disulfonate

Systemtic Name: bis[4-methyl-2-oxidanylidene-6-[(E)-2-phenylethenyl]pyridin-1-yl] butane-1,4-disulfonate Openeye Name: bis[4-methyl-2-oxo-6-[(E)-styryl]-1-pyridyl] butane-1,4-disulfonate CAS Name: butane-1,4-disulfonic acid bis[4-methyl-2-oxo-6-[(E)-2-phenylethenyl]-1-pyridinyl] ester IUPAC Name: bis[4-methyl-2-oxo-6-[(E)-2-phenylethenyl]pyridin-1-yl] butane-1,4-disulfonate Traditional Name: butane-1,4-disulfonic acid bis[2-keto-4-methyl-6-[(E)-styryl]-1-pyridyl] ester Formula: C32H32N2O8S2 MolecularWeight: 636.73508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=C1)C=CC2=CC=CC=C2)OS(=O)(=O)CCCCS(=O)(=O)ON3C(=CC(=CC3=O)C)C=CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=O)N(C(=C1)/C=C/C2=CC=CC=C2)OS(=O)(=O)CCCCS(=O)(=O)ON3C(=O)C=C(C=C3/C=C/C4=CC=CC=C4)C

InChI

InChI=1S/C32H32N2O8S2/c1-25-21-29(17-15-27-11-5-3-6-12-27)33(31(35)23-25)41-43(37,38)19-9-10-20-44(39,40)42-34-30(22-26(2)24-32(34)36)18-16-28-13-7-4-8-14-28/h3-8,11-18,21-24H,9-10,19-20H2,1-2H3/b17-15+,18-16+