2-[(4,4-dimethyl-2-oxidanidyl-6-oxidanylidene-cyclohexen-1-yl)disulfanyl]-5,5-dimethyl-3-oxidanylidene-cyclohexen-1-olate; morpholin-4-ium

Systemtic Name: 2-[(4,4-dimethyl-2-oxidanidyl-6-oxidanylidene-cyclohexen-1-yl)disulfanyl]-5,5-dimethyl-3-oxidanylidene-cyclohexen-1-olate; morpholin-4-ium Openeye Name: 2-[(4,4-dimethyl-2-oxido-6-oxo-cyclohexen-1-yl)disulfanyl]-5,5-dimethyl-3-oxo-cyclohexen-1-olate; morpholin-4-ium CAS Name: 2-[(4,4-dimethyl-2-oxido-6-oxo-1-cyclohexenyl)disulfanyl]-5,5-dimethyl-3-oxo-1-cyclohexenolate; morpholin-4-ium IUPAC Name: 2-[(4,4-dimethyl-2-oxido-6-oxocyclohexen-1-yl)disulfanyl]-5,5-dimethyl-3-oxocyclohexen-1-olate; morpholin-4-ium Traditional Name: 3-keto-2-[(6-keto-4,4-dimethyl-2-oxido-cyclohexen-1-yl)disulfanyl]-5,5-dimethyl-cyclohexen-1-olate; morpholin-4-ium Formula: C24H40N2O6S2 MolecularWeight: 516.7142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)SSC2=C(CC(CC2=O)(C)C)[O-])[O-])C.C1COCC[NH2+]1.C1COCC[NH2+]1

Isomeric SMILES

CC1(CC(=C(C(=O)C1)SSC2=C(CC(CC2=O)(C)C)[O-])[O-])C.C1COCC[NH2+]1.C1COCC[NH2+]1

InChI

InChI=1S/C16H22O4S2.2C4H9NO/c1-15(2)5-9(17)13(10(18)6-15)21-22-14-11(19)7-16(3,4)8-12(14)20;2*1-3-6-4-2-5-1/h17,19H,5-8H2,1-4H3;2*5H,1-4H2