[4-(phenylcarbonyl)phenyl] 3-aminocarbonyl-4-methyl-benzenesulfonate

Systemtic Name: [4-(phenylcarbonyl)phenyl] 3-aminocarbonyl-4-methyl-benzenesulfonate Openeye Name: (4-benzoylphenyl) 3-carbamoyl-4-methyl-benzenesulfonate CAS Name: 3-carbamoyl-4-methylbenzenesulfonic acid (4-benzoylphenyl) ester IUPAC Name: (4-benzoylphenyl) 3-carbamoyl-4-methylbenzenesulfonate Traditional Name: 3-carbamoyl-4-methyl-benzenesulfonic acid (4-benzoylphenyl) ester Formula: C21H17NO5S MolecularWeight: 395.42838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C(=O)C3=CC=CC=C3)C(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C(=O)C3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C21H17NO5S/c1-14-7-12-18(13-19(14)21(22)24)28(25,26)27-17-10-8-16(9-11-17)20(23)15-5-3-2-4-6-15/h2-13H,1H3,(H2,22,24)