tert-butyl 4-[2-(2-methylphenyl)ethynyl]-4-oxidanyl-piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-(2-methylphenyl)ethynyl]-4-oxidanyl-piperidine-1-carboxylate Openeye Name: tert-butyl 4-hydroxy-4-[2-(o-tolyl)ethynyl]piperidine-1-carboxylate CAS Name: 4-hydroxy-4-[2-(2-methylphenyl)ethynyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-hydroxy-4-[2-(2-methylphenyl)ethynyl]piperidine-1-carboxylate Traditional Name: 4-hydroxy-4-[2-(o-tolyl)ethynyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C19H25NO3 MolecularWeight: 315.4067

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C#CC2(CCN(CC2)C(=O)OC(C)(C)C)O

Isomeric SMILES

CC1=CC=CC=C1C#CC2(CCN(CC2)C(=O)OC(C)(C)C)O

InChI

InChI=1S/C19H25NO3/c1-15-7-5-6-8-16(15)9-10-19(22)11-13-20(14-12-19)17(21)23-18(2,3)4/h5-8,22H,11-14H2,1-4H3