(phenylmethyl) (2R)-2-[2-(3,4-dimethoxyphenyl)-2-oxidanyl-ethyl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2R)-2-[2-(3,4-dimethoxyphenyl)-2-oxidanyl-ethyl]piperidine-1-carboxylate Openeye Name: benzyl (2R)-2-[2-(3,4-dimethoxyphenyl)-2-hydroxy-ethyl]piperidine-1-carboxylate CAS Name: (2R)-2-[2-(3,4-dimethoxyphenyl)-2-hydroxyethyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2R)-2-[2-(3,4-dimethoxyphenyl)-2-hydroxyethyl]piperidine-1-carboxylate Traditional Name: (2R)-2-[2-(3,4-dimethoxyphenyl)-2-hydroxy-ethyl]piperidine-1-carboxylic acid benzyl ester Formula: C23H29NO5 MolecularWeight: 399.48006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CC2CCCCN2C(=O)OCC3=CC=CC=C3)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(C[C@H]2CCCCN2C(=O)OCC3=CC=CC=C3)O)OC

InChI

InChI=1S/C23H29NO5/c1-27-21-12-11-18(14-22(21)28-2)20(25)15-19-10-6-7-13-24(19)23(26)29-16-17-8-4-3-5-9-17/h3-5,8-9,11-12,14,19-20,25H,6-7,10,13,15-16H2,1-2H3/t19-,20?/m1/s1