2-[(2-chloranyl-5-piperidin-1-ylsulfonyl-phenyl)methoxy]-1-(2,5-dimethoxyphenyl)ethanone

Systemtic Name: 2-[(2-chloranyl-5-piperidin-1-ylsulfonyl-phenyl)methoxy]-1-(2,5-dimethoxyphenyl)ethanone Openeye Name: 2-[[2-chloro-5-(1-piperidylsulfonyl)phenyl]methoxy]-1-(2,5-dimethoxyphenyl)ethanone CAS Name: 2-[[2-chloro-5-(1-piperidinylsulfonyl)phenyl]methoxy]-1-(2,5-dimethoxyphenyl)ethanone IUPAC Name: 2-[(2-chloro-5-piperidin-1-ylsulfonylphenyl)methoxy]-1-(2,5-dimethoxyphenyl)ethanone Traditional Name: 2-(2-chloro-5-piperidinosulfonyl-benzyl)oxy-1-(2,5-dimethoxyphenyl)ethanone Formula: C22H26ClNO6S MolecularWeight: 467.96294

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C(=O)COCC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)Cl

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C(=O)COCC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)Cl

InChI

InChI=1S/C22H26ClNO6S/c1-28-17-6-9-22(29-2)19(13-17)21(25)15-30-14-16-12-18(7-8-20(16)23)31(26,27)24-10-4-3-5-11-24/h6-9,12-13H,3-5,10-11,14-15H2,1-2H3