(phenylmethyl) (2R,6R)-2-(2-methoxy-2-oxidanylidene-ethyl)-6-propyl-piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2R,6R)-2-(2-methoxy-2-oxidanylidene-ethyl)-6-propyl-piperidine-1-carboxylate Openeye Name: benzyl (2R,6R)-2-(2-methoxy-2-oxo-ethyl)-6-propyl-piperidine-1-carboxylate CAS Name: (2R,6R)-2-(2-methoxy-2-oxoethyl)-6-propyl-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2R,6R)-2-(2-methoxy-2-oxoethyl)-6-propylpiperidine-1-carboxylate Traditional Name: (2R,6R)-2-(2-keto-2-methoxy-ethyl)-6-propyl-piperidine-1-carboxylic acid benzyl ester Formula: C19H27NO4 MolecularWeight: 333.42198

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCCC(N1C(=O)OCC2=CC=CC=C2)CC(=O)OC

Isomeric SMILES

CCC[C@@H]1CCC[C@@H](N1C(=O)OCC2=CC=CC=C2)CC(=O)OC

InChI

InChI=1S/C19H27NO4/c1-3-8-16-11-7-12-17(13-18(21)23-2)20(16)19(22)24-14-15-9-5-4-6-10-15/h4-6,9-10,16-17H,3,7-8,11-14H2,1-2H3/t16-,17-/m1/s1