5-[3-[1-[4-(1-oxidanylhexyl)phenyl]-6-oxidanylidene-piperidin-2-yl]propyl]thiophene-2-carboxylic acid

Systemtic Name: 5-[3-[1-[4-(1-oxidanylhexyl)phenyl]-6-oxidanylidene-piperidin-2-yl]propyl]thiophene-2-carboxylic acid Openeye Name: 5-[3-[1-[4-(1-hydroxyhexyl)phenyl]-6-oxo-2-piperidyl]propyl]thiophene-2-carboxylic acid CAS Name: 5-[3-[1-[4-(1-hydroxyhexyl)phenyl]-6-oxo-2-piperidinyl]propyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[3-[1-[4-(1-hydroxyhexyl)phenyl]-6-oxopiperidin-2-yl]propyl]thiophene-2-carboxylic acid Traditional Name: 5-[3-[1-[4-(1-hydroxyhexyl)phenyl]-6-keto-2-piperidyl]propyl]-2-thenoic acid Formula: C25H33NO4S MolecularWeight: 443.59882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=CC=C(C=C1)N2C(CCCC2=O)CCCC3=CC=C(S3)C(=O)O)O

Isomeric SMILES

CCCCCC(C1=CC=C(C=C1)N2C(CCCC2=O)CCCC3=CC=C(S3)C(=O)O)O

InChI

InChI=1S/C25H33NO4S/c1-2-3-4-10-22(27)18-12-14-20(15-13-18)26-19(8-6-11-24(26)28)7-5-9-21-16-17-23(31-21)25(29)30/h12-17,19,22,27H,2-11H2,1H3,(H,29,30)