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

Systemtic Name: [2-[4-(4-methylphenyl)sulfonyloxyphenyl]-2-oxidanylidene-ethyl] 4-[(4-ethoxyphenyl)amino]-4-oxidanylidene-butanoate Openeye Name: [2-oxo-2-[4-(p-tolylsulfonyloxy)phenyl]ethyl] 4-(4-ethoxyanilino)-4-oxo-butanoate CAS Name: 4-(4-ethoxyanilino)-4-oxobutanoic acid [2-[4-(4-methylphenyl)sulfonyloxyphenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(4-methylphenyl)sulfonyloxyphenyl]-2-oxoethyl] 4-(4-ethoxyanilino)-4-oxobutanoate Traditional Name: 4-keto-4-(p-phenetidino)butyric acid [2-keto-2-(4-tosyloxyphenyl)ethyl] ester Formula: C27H27NO8S MolecularWeight: 525.57018

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C27H27NO8S/c1-3-34-22-12-8-21(9-13-22)28-26(30)16-17-27(31)35-18-25(29)20-6-10-23(11-7-20)36-37(32,33)24-14-4-19(2)5-15-24/h4-15H,3,16-18H2,1-2H3,(H,28,30)