7-[6-oxidanylidene-1-[4-[oxidanyl-(1-propylcyclobutyl)methyl]phenyl]piperidin-2-yl]heptanoic acid

Systemtic Name: 7-[6-oxidanylidene-1-[4-[oxidanyl-(1-propylcyclobutyl)methyl]phenyl]piperidin-2-yl]heptanoic acid Openeye Name: 7-[1-[4-[hydroxy-(1-propylcyclobutyl)methyl]phenyl]-6-oxo-2-piperidyl]heptanoic acid CAS Name: 7-[1-[4-[hydroxy-(1-propylcyclobutyl)methyl]phenyl]-6-oxo-2-piperidinyl]heptanoic acid IUPAC Name: 7-[1-[4-[hydroxy-(1-propylcyclobutyl)methyl]phenyl]-6-oxopiperidin-2-yl]heptanoic acid Traditional Name: 7-[1-[4-[hydroxy-(1-propylcyclobutyl)methyl]phenyl]-6-keto-2-piperidyl]enanthic acid Formula: C26H39NO4 MolecularWeight: 429.59216

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CCC1)C(C2=CC=C(C=C2)N3C(CCCC3=O)CCCCCCC(=O)O)O

Isomeric SMILES

CCCC1(CCC1)C(C2=CC=C(C=C2)N3C(CCCC3=O)CCCCCCC(=O)O)O

InChI

InChI=1S/C26H39NO4/c1-2-17-26(18-8-19-26)25(31)20-13-15-22(16-14-20)27-21(10-7-11-23(27)28)9-5-3-4-6-12-24(29)30/h13-16,21,25,31H,2-12,17-19H2,1H3,(H,29,30)