2-phenyl-2-[1-(phenylsulfonyl)piperidin-3-yl]oxy-piperazine-1-carboxylic acid

Systemtic Name: 2-phenyl-2-[1-(phenylsulfonyl)piperidin-3-yl]oxy-piperazine-1-carboxylic acid Openeye Name: 2-[[1-(benzenesulfonyl)-3-piperidyl]oxy]-2-phenyl-piperazine-1-carboxylic acid CAS Name: 2-[[1-(benzenesulfonyl)-3-piperidinyl]oxy]-2-phenyl-1-piperazinecarboxylic acid IUPAC Name: 2-[1-(benzenesulfonyl)piperidin-3-yl]oxy-2-phenylpiperazine-1-carboxylic acid Traditional Name: 2-[(1-besyl-3-piperidyl)oxy]-2-phenyl-piperazine-1-carboxylic acid Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)OC3(CNCCN3C(=O)O)C4=CC=CC=C4

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)OC3(CNCCN3C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C22H27N3O5S/c26-21(27)25-15-13-23-17-22(25,18-8-3-1-4-9-18)30-19-10-7-14-24(16-19)31(28,29)20-11-5-2-6-12-20/h1-6,8-9,11-12,19,23H,7,10,13-17H2,(H,26,27)