6-cyclohexyl-8-[4-(3-hydroxyphenyl)-3,4-dimethyl-piperidin-1-yl]-5-oxidanylidene-octanoic acid

Systemtic Name: 6-cyclohexyl-8-[4-(3-hydroxyphenyl)-3,4-dimethyl-piperidin-1-yl]-5-oxidanylidene-octanoic acid Openeye Name: 6-cyclohexyl-8-[4-(3-hydroxyphenyl)-3,4-dimethyl-1-piperidyl]-5-oxo-octanoic acid CAS Name: 6-cyclohexyl-8-[4-(3-hydroxyphenyl)-3,4-dimethyl-1-piperidinyl]-5-oxooctanoic acid IUPAC Name: 6-cyclohexyl-8-[4-(3-hydroxyphenyl)-3,4-dimethylpiperidin-1-yl]-5-oxooctanoic acid Traditional Name: 6-cyclohexyl-8-[4-(3-hydroxyphenyl)-3,4-dimethyl-piperidino]-5-keto-caprylic acid Formula: C27H41NO4 MolecularWeight: 443.61874

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCC1(C)C2=CC(=CC=C2)O)CCC(C3CCCCC3)C(=O)CCCC(=O)O

Isomeric SMILES

CC1CN(CCC1(C)C2=CC(=CC=C2)O)CCC(C3CCCCC3)C(=O)CCCC(=O)O

InChI

InChI=1S/C27H41NO4/c1-20-19-28(17-15-27(20,2)22-10-6-11-23(29)18-22)16-14-24(21-8-4-3-5-9-21)25(30)12-7-13-26(31)32/h6,10-11,18,20-21,24,29H,3-5,7-9,12-17,19H2,1-2H3,(H,31,32)