[2-oxidanylidene-2-(4-piperidin-1-ylsulfonylphenyl)ethyl] 3-(1H-indol-3-yl)propanoate

Systemtic Name: [2-oxidanylidene-2-(4-piperidin-1-ylsulfonylphenyl)ethyl] 3-(1H-indol-3-yl)propanoate Openeye Name: [2-oxo-2-[4-(1-piperidylsulfonyl)phenyl]ethyl] 3-(1H-indol-3-yl)propanoate CAS Name: 3-(1H-indol-3-yl)propanoic acid [2-oxo-2-[4-(1-piperidinylsulfonyl)phenyl]ethyl] ester IUPAC Name: [2-oxo-2-(4-piperidin-1-ylsulfonylphenyl)ethyl] 3-(1H-indol-3-yl)propanoate Traditional Name: 3-(1H-indol-3-yl)propionic acid [2-keto-2-(4-piperidinosulfonylphenyl)ethyl] ester Formula: C24H26N2O5S MolecularWeight: 454.53864

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)COC(=O)CCC3=CNC4=CC=CC=C43

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)COC(=O)CCC3=CNC4=CC=CC=C43

InChI

InChI=1S/C24H26N2O5S/c27-23(17-31-24(28)13-10-19-16-25-22-7-3-2-6-21(19)22)18-8-11-20(12-9-18)32(29,30)26-14-4-1-5-15-26/h2-3,6-9,11-12,16,25H,1,4-5,10,13-15,17H2