tert-butyl (3R,4S)-4-(4-hydroxyphenyl)-3-methyl-piperidine-1-carboxylate

Systemtic Name: tert-butyl (3R,4S)-4-(4-hydroxyphenyl)-3-methyl-piperidine-1-carboxylate Openeye Name: tert-butyl (3R,4S)-4-(4-hydroxyphenyl)-3-methyl-piperidine-1-carboxylate CAS Name: (3R,4S)-4-(4-hydroxyphenyl)-3-methyl-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3R,4S)-4-(4-hydroxyphenyl)-3-methylpiperidine-1-carboxylate Traditional Name: (3R,4S)-4-(4-hydroxyphenyl)-3-methyl-piperidine-1-carboxylic acid tert-butyl ester Formula: C17H25NO3 MolecularWeight: 291.3853

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCC1C2=CC=C(C=C2)O)C(=O)OC(C)(C)C

Isomeric SMILES

C[C@H]1CN(CC[C@@H]1C2=CC=C(C=C2)O)C(=O)OC(C)(C)C

InChI

InChI=1S/C17H25NO3/c1-12-11-18(16(20)21-17(2,3)4)10-9-15(12)13-5-7-14(19)8-6-13/h5-8,12,15,19H,9-11H2,1-4H3/t12-,15-/m0/s1