pyridin-4-yl 3,4,5-trimethoxy-1-methyl-6-oxidanylidene-cyclohexa-2,4-diene-1-sulfonate

Systemtic Name: pyridin-4-yl 3,4,5-trimethoxy-1-methyl-6-oxidanylidene-cyclohexa-2,4-diene-1-sulfonate Openeye Name: 4-pyridyl 3,4,5-trimethoxy-1-methyl-6-oxo-cyclohexa-2,4-diene-1-sulfonate CAS Name: 3,4,5-trimethoxy-1-methyl-6-oxo-1-cyclohexa-2,4-dienesulfonic acid pyridin-4-yl ester IUPAC Name: pyridin-4-yl 3,4,5-trimethoxy-1-methyl-6-oxocyclohexa-2,4-diene-1-sulfonate Traditional Name: 6-keto-3,4,5-trimethoxy-1-methyl-cyclohexa-2,4-diene-1-sulfonic acid 4-pyridyl ester Formula: C15H17NO7S MolecularWeight: 355.36298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C=C(C(=C(C1=O)OC)OC)OC)S(=O)(=O)OC2=CC=NC=C2

Isomeric SMILES

CC1(C=C(C(=C(C1=O)OC)OC)OC)S(=O)(=O)OC2=CC=NC=C2

InChI

InChI=1S/C15H17NO7S/c1-15(24(18,19)23-10-5-7-16-8-6-10)9-11(20-2)12(21-3)13(22-4)14(15)17/h5-9H,1-4H3