phenyl 3-[2-[2-[(4-methylphenyl)sulfonylamino]ethanoylamino]ethanoyloxymethyl]benzoate

Systemtic Name: phenyl 3-[2-[2-[(4-methylphenyl)sulfonylamino]ethanoylamino]ethanoyloxymethyl]benzoate Openeye Name: phenyl 3-[[2-[[2-(p-tolylsulfonylamino)acetyl]amino]acetyl]oxymethyl]benzoate CAS Name: 3-[[2-[[2-[(4-methylphenyl)sulfonylamino]-1-oxoethyl]amino]-1-oxoethoxy]methyl]benzoic acid phenyl ester IUPAC Name: phenyl 3-[[2-[[2-[(4-methylphenyl)sulfonylamino]acetyl]amino]acetyl]oxymethyl]benzoate Traditional Name: 3-[[2-[[2-(tosylamino)acetyl]amino]acetyl]oxymethyl]benzoic acid phenyl ester Formula: C25H24N2O7S MolecularWeight: 496.53226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)NCC(=O)OCC2=CC=CC(=C2)C(=O)OC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)NCC(=O)OCC2=CC=CC(=C2)C(=O)OC3=CC=CC=C3

InChI

InChI=1S/C25H24N2O7S/c1-18-10-12-22(13-11-18)35(31,32)27-15-23(28)26-16-24(29)33-17-19-6-5-7-20(14-19)25(30)34-21-8-3-2-4-9-21/h2-14,27H,15-17H2,1H3,(H,26,28)