5-(hydroxymethyl)-1-naphthalen-2-ylsulfonyl-piperidine-3-carboxylic acid

Systemtic Name: 5-(hydroxymethyl)-1-naphthalen-2-ylsulfonyl-piperidine-3-carboxylic acid Openeye Name: 5-(hydroxymethyl)-1-(2-naphthylsulfonyl)piperidine-3-carboxylic acid CAS Name: 5-(hydroxymethyl)-1-(2-naphthalenylsulfonyl)-3-piperidinecarboxylic acid IUPAC Name: 5-(hydroxymethyl)-1-naphthalen-2-ylsulfonylpiperidine-3-carboxylic acid Traditional Name: 5-methylol-1-(2-naphthylsulfonyl)nipecotic acid Formula: C17H19NO5S MolecularWeight: 349.40146

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(CC1C(=O)O)S(=O)(=O)C2=CC3=CC=CC=C3C=C2)CO

Isomeric SMILES

C1C(CN(CC1C(=O)O)S(=O)(=O)C2=CC3=CC=CC=C3C=C2)CO

InChI

InChI=1S/C17H19NO5S/c19-11-12-7-15(17(20)21)10-18(9-12)24(22,23)16-6-5-13-3-1-2-4-14(13)8-16/h1-6,8,12,15,19H,7,9-11H2,(H,20,21)