4-[4-(8-oxidanylidene-8-piperidin-1-yl-octoxy)phenyl]benzoic acid

Systemtic Name: 4-[4-(8-oxidanylidene-8-piperidin-1-yl-octoxy)phenyl]benzoic acid Openeye Name: 4-[4-[8-oxo-8-(1-piperidyl)octoxy]phenyl]benzoic acid CAS Name: 4-[4-[8-oxo-8-(1-piperidinyl)octoxy]phenyl]benzoic acid IUPAC Name: 4-[4-(8-oxo-8-piperidin-1-yloctoxy)phenyl]benzoic acid Traditional Name: 4-[4-(8-keto-8-piperidino-octoxy)phenyl]benzoic acid Formula: C26H33NO4 MolecularWeight: 423.54452

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CCCCCCCOC2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1CCN(CC1)C(=O)CCCCCCCOC2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C26H33NO4/c28-25(27-18-6-4-7-19-27)9-5-2-1-3-8-20-31-24-16-14-22(15-17-24)21-10-12-23(13-11-21)26(29)30/h10-17H,1-9,18-20H2,(H,29,30)