tert-butyl (2S)-2-[(5E,7E)-dodeca-5,7-dien-3-ynyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2S)-2-[(5E,7E)-dodeca-5,7-dien-3-ynyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S)-2-[(5E,7E)-dodeca-5,7-dien-3-ynyl]pyrrolidine-1-carboxylate CAS Name: (2S)-2-[(5E,7E)-dodeca-5,7-dien-3-ynyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[(5E,7E)-dodeca-5,7-dien-3-ynyl]pyrrolidine-1-carboxylate Traditional Name: (2S)-2-[(5E,7E)-dodeca-5,7-dien-3-ynyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C21H33NO2 MolecularWeight: 331.49222

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC=CC=CC#CCCC1CCCN1C(=O)OC(C)(C)C

Isomeric SMILES

CCCC/C=C/C=C/C#CCC[C@H]1CCCN1C(=O)OC(C)(C)C

InChI

InChI=1S/C21H33NO2/c1-5-6-7-8-9-10-11-12-13-14-16-19-17-15-18-22(19)20(23)24-21(2,3)4/h8-11,19H,5-7,14-18H2,1-4H3/b9-8+,11-10+/t19-/m0/s1