[2-[4-(4-methylphenyl)sulfonyloxyphenyl]-2-oxidanylidene-ethyl] 3-[(4-methylphenyl)carbonylamino]benzoate

Systemtic Name: [2-[4-(4-methylphenyl)sulfonyloxyphenyl]-2-oxidanylidene-ethyl] 3-[(4-methylphenyl)carbonylamino]benzoate Openeye Name: [2-oxo-2-[4-(p-tolylsulfonyloxy)phenyl]ethyl] 3-[(4-methylbenzoyl)amino]benzoate CAS Name: 3-[[(4-methylphenyl)-oxomethyl]amino]benzoic acid [2-[4-(4-methylphenyl)sulfonyloxyphenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(4-methylphenyl)sulfonyloxyphenyl]-2-oxoethyl] 3-[(4-methylbenzoyl)amino]benzoate Traditional Name: 3-(p-toluoylamino)benzoic acid [2-keto-2-(4-tosyloxyphenyl)ethyl] ester Formula: C30H25NO7S MolecularWeight: 543.587

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C(=O)OCC(=O)C3=CC=C(C=C3)OS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C(=O)OCC(=O)C3=CC=C(C=C3)OS(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C30H25NO7S/c1-20-6-10-23(11-7-20)29(33)31-25-5-3-4-24(18-25)30(34)37-19-28(32)22-12-14-26(15-13-22)38-39(35,36)27-16-8-21(2)9-17-27/h3-18H,19H2,1-2H3,(H,31,33)