4-(4-phenoxyphenyl)sulfonylpiperidine-4-carboxylic acid

Systemtic Name: 4-(4-phenoxyphenyl)sulfonylpiperidine-4-carboxylic acid Openeye Name: 4-(4-phenoxyphenyl)sulfonylpiperidine-4-carboxylic acid CAS Name: 4-(4-phenoxyphenyl)sulfonyl-4-piperidinecarboxylic acid IUPAC Name: 4-(4-phenoxyphenyl)sulfonylpiperidine-4-carboxylic acid Traditional Name: 4-(4-phenoxyphenyl)sulfonylisonipecotic acid Formula: C18H19NO5S MolecularWeight: 361.41216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1(C(=O)O)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

C1CNCCC1(C(=O)O)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C18H19NO5S/c20-17(21)18(10-12-19-13-11-18)25(22,23)16-8-6-15(7-9-16)24-14-4-2-1-3-5-14/h1-9,19H,10-13H2,(H,20,21)