phenyl (5E)-5-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-3-propan-2-ylsulfonyl-1H-imidazo[1,2-a]pyridine-7-sulfonate

Systemtic Name: phenyl (5E)-5-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-3-propan-2-ylsulfonyl-1H-imidazo[1,2-a]pyridine-7-sulfonate Openeye Name: phenyl (5E)-3-isopropylsulfonyl-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-imidazo[1,2-a]pyridine-7-sulfonate CAS Name: (5E)-5-(6-oxo-1-cyclohexa-2,4-dienylidene)-3-propan-2-ylsulfonyl-1H-imidazo[1,2-a]pyridine-7-sulfonic acid phenyl ester IUPAC Name: phenyl (5E)-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-3-propan-2-ylsulfonyl-1H-imidazo[1,2-a]pyridine-7-sulfonate Traditional Name: (5E)-3-isopropylsulfonyl-5-(6-ketocyclohexa-2,4-dien-1-ylidene)-1H-imidazo[1,2-a]pyridine-7-sulfonic acid phenyl ester Formula: C22H20N2O6S2 MolecularWeight: 472.534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=CNC2=CC(=CC(=C3C=CC=CC3=O)N21)S(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

CC(C)S(=O)(=O)C1=CNC2=CC(=C/C(=C\3/C=CC=CC3=O)/N21)S(=O)(=O)OC4=CC=CC=C4

InChI

InChI=1S/C22H20N2O6S2/c1-15(2)31(26,27)22-14-23-21-13-17(32(28,29)30-16-8-4-3-5-9-16)12-19(24(21)22)18-10-6-7-11-20(18)25/h3-15,23H,1-2H3/b19-18+