(phenylmethyl) (2S)-2-[(E)-4-oxidanylhept-2-enyl]pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2S)-2-[(E)-4-oxidanylhept-2-enyl]pyrrolidine-1-carboxylate Openeye Name: benzyl (2S)-2-[(E)-4-hydroxyhept-2-enyl]pyrrolidine-1-carboxylate CAS Name: (2S)-2-[(E)-4-hydroxyhept-2-enyl]-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-[(E)-4-hydroxyhept-2-enyl]pyrrolidine-1-carboxylate Traditional Name: (2S)-2-[(E)-4-hydroxyhept-2-enyl]pyrrolidine-1-carboxylic acid benzyl ester Formula: C19H27NO3 MolecularWeight: 317.42258

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C=CCC1CCCN1C(=O)OCC2=CC=CC=C2)O

Isomeric SMILES

CCCC(/C=C/C[C@@H]1CCCN1C(=O)OCC2=CC=CC=C2)O

InChI

InChI=1S/C19H27NO3/c1-2-8-18(21)13-6-11-17-12-7-14-20(17)19(22)23-15-16-9-4-3-5-10-16/h3-6,9-10,13,17-18,21H,2,7-8,11-12,14-15H2,1H3/b13-6+/t17-,18?/m1/s1