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

Systemtic Name: (phenylmethyl) (2R)-2-[2-(3,4-dimethoxyphenyl)-2-methylsulfonyloxy-ethyl]piperidine-1-carboxylate Openeye Name: benzyl (2R)-2-[2-(3,4-dimethoxyphenyl)-2-methylsulfonyloxy-ethyl]piperidine-1-carboxylate CAS Name: (2R)-2-[2-(3,4-dimethoxyphenyl)-2-methylsulfonyloxyethyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2R)-2-[2-(3,4-dimethoxyphenyl)-2-methylsulfonyloxyethyl]piperidine-1-carboxylate Traditional Name: (2R)-2-[2-(3,4-dimethoxyphenyl)-2-methylsulfonyloxy-ethyl]piperidine-1-carboxylic acid benzyl ester Formula: C24H31NO7S MolecularWeight: 477.57044

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H31NO7S/c1-29-21-13-12-19(15-23(21)30-2)22(32-33(3,27)28)16-20-11-7-8-14-25(20)24(26)31-17-18-9-5-4-6-10-18/h4-6,9-10,12-13,15,20,22H,7-8,11,14,16-17H2,1-3H3/t20-,22?/m1/s1