[5-(2-methyloctan-2-yl)-2-(3-oxidanylcyclohexyl)phenyl] 4-piperidin-1-ylbutanoate

Systemtic Name: [5-(2-methyloctan-2-yl)-2-(3-oxidanylcyclohexyl)phenyl] 4-piperidin-1-ylbutanoate Openeye Name: [5-(1,1-dimethylheptyl)-2-(3-hydroxycyclohexyl)phenyl] 4-(1-piperidyl)butanoate CAS Name: 4-(1-piperidinyl)butanoic acid [2-(3-hydroxycyclohexyl)-5-(2-methyloctan-2-yl)phenyl] ester IUPAC Name: [2-(3-hydroxycyclohexyl)-5-(2-methyloctan-2-yl)phenyl] 4-piperidin-1-ylbutanoate Traditional Name: 4-piperidinobutyric acid [5-(1,1-dimethylheptyl)-2-(3-hydroxycyclohexyl)phenyl] ester Formula: C30H49NO3 MolecularWeight: 471.71496

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C)C1=CC(=C(C=C1)C2CCCC(C2)O)OC(=O)CCCN3CCCCC3

Isomeric SMILES

CCCCCCC(C)(C)C1=CC(=C(C=C1)C2CCCC(C2)O)OC(=O)CCCN3CCCCC3

InChI

InChI=1S/C30H49NO3/c1-4-5-6-8-18-30(2,3)25-16-17-27(24-13-11-14-26(32)22-24)28(23-25)34-29(33)15-12-21-31-19-9-7-10-20-31/h16-17,23-24,26,32H,4-15,18-22H2,1-3H3