2-(2-chloranyl-4-pyrrolidin-1-ylsulfonyl-phenoxy)-1-[4-(phenylmethyl)piperidin-1-yl]ethanone

Systemtic Name: 2-(2-chloranyl-4-pyrrolidin-1-ylsulfonyl-phenoxy)-1-[4-(phenylmethyl)piperidin-1-yl]ethanone Openeye Name: 1-(4-benzyl-1-piperidyl)-2-(2-chloro-4-pyrrolidin-1-ylsulfonyl-phenoxy)ethanone CAS Name: 2-[2-chloro-4-(1-pyrrolidinylsulfonyl)phenoxy]-1-[4-(phenylmethyl)-1-piperidinyl]ethanone IUPAC Name: 1-(4-benzylpiperidin-1-yl)-2-(2-chloro-4-pyrrolidin-1-ylsulfonylphenoxy)ethanone Traditional Name: 1-(4-benzylpiperidino)-2-(2-chloro-4-pyrrolidinosulfonyl-phenoxy)ethanone Formula: C24H29ClN2O4S MolecularWeight: 477.01606

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OCC(=O)N3CCC(CC3)CC4=CC=CC=C4)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OCC(=O)N3CCC(CC3)CC4=CC=CC=C4)Cl

InChI

InChI=1S/C24H29ClN2O4S/c25-22-17-21(32(29,30)27-12-4-5-13-27)8-9-23(22)31-18-24(28)26-14-10-20(11-15-26)16-19-6-2-1-3-7-19/h1-3,6-9,17,20H,4-5,10-16,18H2