3-[2-oxidanyl-3-(4-oxidanyl-4-phenyl-piperidin-1-yl)propoxy]thiophene-2-carboxylic acid

Systemtic Name: 3-[2-oxidanyl-3-(4-oxidanyl-4-phenyl-piperidin-1-yl)propoxy]thiophene-2-carboxylic acid Openeye Name: 3-[2-hydroxy-3-(4-hydroxy-4-phenyl-1-piperidyl)propoxy]thiophene-2-carboxylic acid CAS Name: 3-[2-hydroxy-3-(4-hydroxy-4-phenyl-1-piperidinyl)propoxy]-2-thiophenecarboxylic acid IUPAC Name: 3-[2-hydroxy-3-(4-hydroxy-4-phenylpiperidin-1-yl)propoxy]thiophene-2-carboxylic acid Traditional Name: 3-[2-hydroxy-3-(4-hydroxy-4-phenyl-piperidino)propoxy]-2-thenoic acid Formula: C19H23NO5S MolecularWeight: 377.45462

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=CC=C2)O)CC(COC3=C(SC=C3)C(=O)O)O

Isomeric SMILES

C1CN(CCC1(C2=CC=CC=C2)O)CC(COC3=C(SC=C3)C(=O)O)O

InChI

InChI=1S/C19H23NO5S/c21-15(13-25-16-6-11-26-17(16)18(22)23)12-20-9-7-19(24,8-10-20)14-4-2-1-3-5-14/h1-6,11,15,21,24H,7-10,12-13H2,(H,22,23)