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

Systemtic Name: (phenylmethyl) 4-[3-[(2R)-3-ethoxy-2-oxidanyl-3-oxidanylidene-propoxy]propyl]piperidine-1-carboxylate Openeye Name: benzyl 4-[3-[(2R)-3-ethoxy-2-hydroxy-3-oxo-propoxy]propyl]piperidine-1-carboxylate CAS Name: 4-[3-[(2R)-3-ethoxy-2-hydroxy-3-oxopropoxy]propyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[3-[(2R)-3-ethoxy-2-hydroxy-3-oxopropoxy]propyl]piperidine-1-carboxylate Traditional Name: 4-[3-[(2R)-3-ethoxy-2-hydroxy-3-keto-propoxy]propyl]piperidine-1-carboxylic acid benzyl ester Formula: C21H31NO6 MolecularWeight: 393.47394

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)[C@@H](COCCCC1CCN(CC1)C(=O)OCC2=CC=CC=C2)O

InChI

InChI=1S/C21H31NO6/c1-2-27-20(24)19(23)16-26-14-6-9-17-10-12-22(13-11-17)21(25)28-15-18-7-4-3-5-8-18/h3-5,7-8,17,19,23H,2,6,9-16H2,1H3/t19-/m1/s1