[2-[4-(4-methylphenyl)sulfonyloxyphenyl]-2-oxidanylidene-ethyl] 5-[(4-ethoxyphenyl)amino]-5-oxidanylidene-pentanoate

Systemtic Name: [2-[4-(4-methylphenyl)sulfonyloxyphenyl]-2-oxidanylidene-ethyl] 5-[(4-ethoxyphenyl)amino]-5-oxidanylidene-pentanoate Openeye Name: [2-oxo-2-[4-(p-tolylsulfonyloxy)phenyl]ethyl] 5-(4-ethoxyanilino)-5-oxo-pentanoate CAS Name: 5-(4-ethoxyanilino)-5-oxopentanoic acid [2-[4-(4-methylphenyl)sulfonyloxyphenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(4-methylphenyl)sulfonyloxyphenyl]-2-oxoethyl] 5-(4-ethoxyanilino)-5-oxopentanoate Traditional Name: 5-keto-5-(p-phenetidino)valeric acid [2-keto-2-(4-tosyloxyphenyl)ethyl] ester Formula: C28H29NO8S MolecularWeight: 539.59676

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CCCC(=O)OCC(=O)C2=CC=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CCCC(=O)OCC(=O)C2=CC=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C28H29NO8S/c1-3-35-23-15-11-22(12-16-23)29-27(31)5-4-6-28(32)36-19-26(30)21-9-13-24(14-10-21)37-38(33,34)25-17-7-20(2)8-18-25/h7-18H,3-6,19H2,1-2H3,(H,29,31)