[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl] 3-[(4-methylphenyl)-(4-methylphenyl)sulfonyl-amino]propanoate

Systemtic Name: [2-(4-methoxyphenyl)-2-oxidanylidene-ethyl] 3-[(4-methylphenyl)-(4-methylphenyl)sulfonyl-amino]propanoate Openeye Name: [2-(4-methoxyphenyl)-2-oxo-ethyl] 3-[4-methyl-N-(p-tolylsulfonyl)anilino]propanoate CAS Name: 3-(4-methyl-N-(4-methylphenyl)sulfonylanilino)propanoic acid [2-(4-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methoxyphenyl)-2-oxoethyl] 3-(4-methyl-N-(4-methylphenyl)sulfonylanilino)propanoate Traditional Name: 3-(4-methyl-N-tosyl-anilino)propionic acid [2-keto-2-(4-methoxyphenyl)ethyl] ester Formula: C26H27NO6S MolecularWeight: 481.56068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CCC(=O)OCC(=O)C2=CC=C(C=C2)OC)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)N(CCC(=O)OCC(=O)C2=CC=C(C=C2)OC)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C26H27NO6S/c1-19-4-10-22(11-5-19)27(34(30,31)24-14-6-20(2)7-15-24)17-16-26(29)33-18-25(28)21-8-12-23(32-3)13-9-21/h4-15H,16-18H2,1-3H3