(phenylmethyl) 4-[3-(3-ethoxy-2-methylsulfonyloxy-3-oxidanylidene-propoxy)propyl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[3-(3-ethoxy-2-methylsulfonyloxy-3-oxidanylidene-propoxy)propyl]piperidine-1-carboxylate Openeye Name: benzyl 4-[3-(3-ethoxy-2-methylsulfonyloxy-3-oxo-propoxy)propyl]piperidine-1-carboxylate CAS Name: 4-[3-(3-ethoxy-2-methylsulfonyloxy-3-oxopropoxy)propyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[3-(3-ethoxy-2-methylsulfonyloxy-3-oxopropoxy)propyl]piperidine-1-carboxylate Traditional Name: 4-[3-(3-ethoxy-3-keto-2-methylsulfonyloxy-propoxy)propyl]piperidine-1-carboxylic acid benzyl ester Formula: C22H33NO8S MolecularWeight: 471.56432

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(COCCCC1CCN(CC1)C(=O)OCC2=CC=CC=C2)OS(=O)(=O)C

Isomeric SMILES

CCOC(=O)C(COCCCC1CCN(CC1)C(=O)OCC2=CC=CC=C2)OS(=O)(=O)C

InChI

InChI=1S/C22H33NO8S/c1-3-29-21(24)20(31-32(2,26)27)17-28-15-7-10-18-11-13-23(14-12-18)22(25)30-16-19-8-5-4-6-9-19/h4-6,8-9,18,20H,3,7,10-17H2,1-2H3