[2-[[4-[bis(fluoranyl)methoxy]phenyl]amino]-2-oxidanylidene-ethyl] 3-(4-piperidin-1-ylsulfonylphenyl)propanoate

Systemtic Name: [2-[[4-[bis(fluoranyl)methoxy]phenyl]amino]-2-oxidanylidene-ethyl] 3-(4-piperidin-1-ylsulfonylphenyl)propanoate Openeye Name: [2-[4-(difluoromethoxy)anilino]-2-oxo-ethyl] 3-[4-(1-piperidylsulfonyl)phenyl]propanoate CAS Name: 3-[4-(1-piperidinylsulfonyl)phenyl]propanoic acid [2-[4-(difluoromethoxy)anilino]-2-oxoethyl] ester IUPAC Name: [2-[4-(difluoromethoxy)anilino]-2-oxoethyl] 3-(4-piperidin-1-ylsulfonylphenyl)propanoate Traditional Name: 3-(4-piperidinosulfonylphenyl)propionic acid [2-[4-(difluoromethoxy)anilino]-2-keto-ethyl] ester Formula: C23H26F2N2O6S MolecularWeight: 496.524146

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)OCC(=O)NC3=CC=C(C=C3)OC(F)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)OCC(=O)NC3=CC=C(C=C3)OC(F)F

InChI

InChI=1S/C23H26F2N2O6S/c24-23(25)33-19-9-7-18(8-10-19)26-21(28)16-32-22(29)13-6-17-4-11-20(12-5-17)34(30,31)27-14-2-1-3-15-27/h4-5,7-12,23H,1-3,6,13-16H2,(H,26,28)