3-oxidanyl-4-[4-[3-(thiophen-3-ylmethoxy)propoxy]phenyl]piperidine-1-carboxylic acid

Systemtic Name: 3-oxidanyl-4-[4-[3-(thiophen-3-ylmethoxy)propoxy]phenyl]piperidine-1-carboxylic acid Openeye Name: 3-hydroxy-4-[4-[3-(3-thienylmethoxy)propoxy]phenyl]piperidine-1-carboxylic acid CAS Name: 3-hydroxy-4-[4-[3-(3-thiophenylmethoxy)propoxy]phenyl]-1-piperidinecarboxylic acid IUPAC Name: 3-hydroxy-4-[4-[3-(thiophen-3-ylmethoxy)propoxy]phenyl]piperidine-1-carboxylic acid Traditional Name: 3-hydroxy-4-[4-[3-(3-thenyloxy)propoxy]phenyl]piperidine-1-carboxylic acid Formula: C20H25NO5S MolecularWeight: 391.4812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(C1C2=CC=C(C=C2)OCCCOCC3=CSC=C3)O)C(=O)O

Isomeric SMILES

C1CN(CC(C1C2=CC=C(C=C2)OCCCOCC3=CSC=C3)O)C(=O)O

InChI

InChI=1S/C20H25NO5S/c22-19-12-21(20(23)24)8-6-18(19)16-2-4-17(5-3-16)26-10-1-9-25-13-15-7-11-27-14-15/h2-5,7,11,14,18-19,22H,1,6,8-10,12-13H2,(H,23,24)