4-methylsulfonyloxy-1-naphthalen-2-ylsulfonyl-piperidine-3-carboxylic acid

Systemtic Name: 4-methylsulfonyloxy-1-naphthalen-2-ylsulfonyl-piperidine-3-carboxylic acid Openeye Name: 4-methylsulfonyloxy-1-(2-naphthylsulfonyl)piperidine-3-carboxylic acid CAS Name: 4-methylsulfonyloxy-1-(2-naphthalenylsulfonyl)-3-piperidinecarboxylic acid IUPAC Name: 4-methylsulfonyloxy-1-naphthalen-2-ylsulfonylpiperidine-3-carboxylic acid Traditional Name: 4-methylsulfonyloxy-1-(2-naphthylsulfonyl)nipecotic acid Formula: C17H19NO7S2 MolecularWeight: 413.46526

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1CCN(CC1C(=O)O)S(=O)(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CS(=O)(=O)OC1CCN(CC1C(=O)O)S(=O)(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C17H19NO7S2/c1-26(21,22)25-16-8-9-18(11-15(16)17(19)20)27(23,24)14-7-6-12-4-2-3-5-13(12)10-14/h2-7,10,15-16H,8-9,11H2,1H3,(H,19,20)