[2,5-bis(oxidanylidene)-3,4-diphenyl-pyrrol-1-yl] 4-methylbenzenesulfonate

Systemtic Name: [2,5-bis(oxidanylidene)-3,4-diphenyl-pyrrol-1-yl] 4-methylbenzenesulfonate Openeye Name: (2,5-dioxo-3,4-diphenyl-pyrrol-1-yl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (2,5-dioxo-3,4-diphenyl-1-pyrrolyl) ester IUPAC Name: (2,5-dioxo-3,4-diphenylpyrrol-1-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2,5-diketo-3,4-diphenyl-3-pyrrolin-1-yl) ester Formula: C23H17NO5S MolecularWeight: 419.44978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)ON2C(=O)C(=C(C2=O)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)ON2C(=O)C(=C(C2=O)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H17NO5S/c1-16-12-14-19(15-13-16)30(27,28)29-24-22(25)20(17-8-4-2-5-9-17)21(23(24)26)18-10-6-3-7-11-18/h2-15H,1H3