(phenylmethyl) (2S)-2-[(E)-12-azidotridec-1-enyl]pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2S)-2-[(E)-12-azidotridec-1-enyl]pyrrolidine-1-carboxylate Openeye Name: benzyl (2S)-2-[(E)-12-azidotridec-1-enyl]pyrrolidine-1-carboxylate CAS Name: (2S)-2-[(E)-12-azidotridec-1-enyl]-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-[(E)-12-azidotridec-1-enyl]pyrrolidine-1-carboxylate Traditional Name: (2S)-2-[(E)-12-azidotridec-1-enyl]pyrrolidine-1-carboxylic acid benzyl ester Formula: C25H38N4O2 MolecularWeight: 426.59482

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCCCCCCC=CC1CCCN1C(=O)OCC2=CC=CC=C2)N=[N+]=[N-]

Isomeric SMILES

CC(CCCCCCCCC/C=C/[C@@H]1CCCN1C(=O)OCC2=CC=CC=C2)N=[N+]=[N-]

InChI

InChI=1S/C25H38N4O2/c1-22(27-28-26)15-10-7-5-3-2-4-6-8-13-18-24-19-14-20-29(24)25(30)31-21-23-16-11-9-12-17-23/h9,11-13,16-18,22,24H,2-8,10,14-15,19-21H2,1H3/b18-13+/t22?,24-/m1/s1