(phenylmethyl) (2R,6R)-2-but-3-enyl-6-butyl-piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2R,6R)-2-but-3-enyl-6-butyl-piperidine-1-carboxylate Openeye Name: benzyl (2R,6R)-2-but-3-enyl-6-butyl-piperidine-1-carboxylate CAS Name: (2R,6R)-2-but-3-enyl-6-butyl-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2R,6R)-2-but-3-enyl-6-butylpiperidine-1-carboxylate Traditional Name: (2R,6R)-2-but-3-enyl-6-butyl-piperidine-1-carboxylic acid benzyl ester Formula: C21H31NO2 MolecularWeight: 329.47634

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCCC(N1C(=O)OCC2=CC=CC=C2)CCC=C

Isomeric SMILES

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

InChI

InChI=1S/C21H31NO2/c1-3-5-13-19-15-10-16-20(14-6-4-2)22(19)21(23)24-17-18-11-8-7-9-12-18/h3,7-9,11-12,19-20H,1,4-6,10,13-17H2,2H3/t19-,20+/m0/s1