ethyl 2-[4-(2-methyloctan-2-yl)-2-oxidanyl-phenyl]-4-oxidanyl-piperidine-1-carboxylate

Systemtic Name: ethyl 2-[4-(2-methyloctan-2-yl)-2-oxidanyl-phenyl]-4-oxidanyl-piperidine-1-carboxylate Openeye Name: ethyl 2-[4-(1,1-dimethylheptyl)-2-hydroxy-phenyl]-4-hydroxy-piperidine-1-carboxylate CAS Name: 4-hydroxy-2-[2-hydroxy-4-(2-methyloctan-2-yl)phenyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-hydroxy-2-[2-hydroxy-4-(2-methyloctan-2-yl)phenyl]piperidine-1-carboxylate Traditional Name: 2-[4-(1,1-dimethylheptyl)-2-hydroxy-phenyl]-4-hydroxy-piperidine-1-carboxylic acid ethyl ester Formula: C23H37NO4 MolecularWeight: 391.54418

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C)C1=CC(=C(C=C1)C2CC(CCN2C(=O)OCC)O)O

Isomeric SMILES

CCCCCCC(C)(C)C1=CC(=C(C=C1)C2CC(CCN2C(=O)OCC)O)O

InChI

InChI=1S/C23H37NO4/c1-5-7-8-9-13-23(3,4)17-10-11-19(21(26)15-17)20-16-18(25)12-14-24(20)22(27)28-6-2/h10-11,15,18,20,25-26H,5-9,12-14,16H2,1-4H3