[2-(2,3-dihydro-1H-inden-5-yl)-2-oxidanylidene-ethyl] 4-chloranyl-3-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: [2-(2,3-dihydro-1H-inden-5-yl)-2-oxidanylidene-ethyl] 4-chloranyl-3-piperidin-1-ylsulfonyl-benzoate Openeye Name: (2-indan-5-yl-2-oxo-ethyl) 4-chloro-3-(1-piperidylsulfonyl)benzoate CAS Name: 4-chloro-3-(1-piperidinylsulfonyl)benzoic acid [2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethyl] ester IUPAC Name: [2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethyl] 4-chloro-3-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-chloro-3-piperidinosulfonyl-benzoic acid (2-indan-5-yl-2-keto-ethyl) ester Formula: C23H24ClNO5S MolecularWeight: 461.95836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC(=O)C3=CC4=C(CCC4)C=C3)Cl

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC(=O)C3=CC4=C(CCC4)C=C3)Cl

InChI

InChI=1S/C23H24ClNO5S/c24-20-10-9-19(14-22(20)31(28,29)25-11-2-1-3-12-25)23(27)30-15-21(26)18-8-7-16-5-4-6-17(16)13-18/h7-10,13-14H,1-6,11-12,15H2