4-phenyl-1-thiophen-2-ylsulfonyl-piperidine-4-carboxylic acid

Systemtic Name: 4-phenyl-1-thiophen-2-ylsulfonyl-piperidine-4-carboxylic acid Openeye Name: 4-phenyl-1-(2-thienylsulfonyl)piperidine-4-carboxylic acid CAS Name: 4-phenyl-1-thiophen-2-ylsulfonyl-4-piperidinecarboxylic acid IUPAC Name: 4-phenyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxylic acid Traditional Name: 4-phenyl-1-(2-thienylsulfonyl)isonipecotic acid Formula: C16H17NO4S2 MolecularWeight: 351.44048

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=CC=C2)C(=O)O)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

C1CN(CCC1(C2=CC=CC=C2)C(=O)O)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C16H17NO4S2/c18-15(19)16(13-5-2-1-3-6-13)8-10-17(11-9-16)23(20,21)14-7-4-12-22-14/h1-7,12H,8-11H2,(H,18,19)