4-methoxy-2-(phenylsulfonyl)-1-propan-2-yl-piperidine-4-carboxylic acid

Systemtic Name: 4-methoxy-2-(phenylsulfonyl)-1-propan-2-yl-piperidine-4-carboxylic acid Openeye Name: 2-(benzenesulfonyl)-1-isopropyl-4-methoxy-piperidine-4-carboxylic acid CAS Name: 2-(benzenesulfonyl)-4-methoxy-1-propan-2-yl-4-piperidinecarboxylic acid IUPAC Name: 2-(benzenesulfonyl)-4-methoxy-1-propan-2-ylpiperidine-4-carboxylic acid Traditional Name: 2-besyl-1-isopropyl-4-methoxy-isonipecotic acid Formula: C16H23NO5S MolecularWeight: 341.42252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCC(CC1S(=O)(=O)C2=CC=CC=C2)(C(=O)O)OC

Isomeric SMILES

CC(C)N1CCC(CC1S(=O)(=O)C2=CC=CC=C2)(C(=O)O)OC

InChI

InChI=1S/C16H23NO5S/c1-12(2)17-10-9-16(22-3,15(18)19)11-14(17)23(20,21)13-7-5-4-6-8-13/h4-8,12,14H,9-11H2,1-3H3,(H,18,19)