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

Systemtic Name: [5-(2-methyloctan-2-yl)-2-piperidin-3-yl-phenyl] 4-piperidin-1-ylbutanoate Openeye Name: [5-(1,1-dimethylheptyl)-2-(3-piperidyl)phenyl] 4-(1-piperidyl)butanoate CAS Name: 4-(1-piperidinyl)butanoic acid [5-(2-methyloctan-2-yl)-2-(3-piperidinyl)phenyl] ester IUPAC Name: [5-(2-methyloctan-2-yl)-2-piperidin-3-ylphenyl] 4-piperidin-1-ylbutanoate Traditional Name: 4-piperidinobutyric acid [5-(1,1-dimethylheptyl)-2-(3-piperidyl)phenyl] ester Formula: C29H48N2O2 MolecularWeight: 456.70362

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C)C1=CC(=C(C=C1)C2CCCNC2)OC(=O)CCCN3CCCCC3

Isomeric SMILES

CCCCCCC(C)(C)C1=CC(=C(C=C1)C2CCCNC2)OC(=O)CCCN3CCCCC3

InChI

InChI=1S/C29H48N2O2/c1-4-5-6-8-17-29(2,3)25-15-16-26(24-13-11-18-30-23-24)27(22-25)33-28(32)14-12-21-31-19-9-7-10-20-31/h15-16,22,24,30H,4-14,17-21,23H2,1-3H3