(phenylmethyl) (2R,6S)-2-[(E)-hex-1-enyl]-6-(hydroxymethyl)piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2R,6S)-2-[(E)-hex-1-enyl]-6-(hydroxymethyl)piperidine-1-carboxylate Openeye Name: benzyl (2R,6S)-2-[(E)-hex-1-enyl]-6-(hydroxymethyl)piperidine-1-carboxylate CAS Name: (2R,6S)-2-[(E)-hex-1-enyl]-6-(hydroxymethyl)-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2R,6S)-2-[(E)-hex-1-enyl]-6-(hydroxymethyl)piperidine-1-carboxylate Traditional Name: (2R,6S)-2-[(E)-hex-1-enyl]-6-methylol-piperidine-1-carboxylic acid benzyl ester Formula: C20H29NO3 MolecularWeight: 331.44916

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC=CC1CCCC(N1C(=O)OCC2=CC=CC=C2)CO

Isomeric SMILES

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

InChI

InChI=1S/C20H29NO3/c1-2-3-4-8-12-18-13-9-14-19(15-22)21(18)20(23)24-16-17-10-6-5-7-11-17/h5-8,10-12,18-19,22H,2-4,9,13-16H2,1H3/b12-8+/t18-,19-/m0/s1