(phenylmethyl) (2R,5S)-2-butyl-5-pent-4-enyl-pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2R,5S)-2-butyl-5-pent-4-enyl-pyrrolidine-1-carboxylate Openeye Name: benzyl (2R,5S)-2-butyl-5-pent-4-enyl-pyrrolidine-1-carboxylate CAS Name: (2R,5S)-2-butyl-5-pent-4-enyl-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2R,5S)-2-butyl-5-pent-4-enylpyrrolidine-1-carboxylate Traditional Name: (2R,5S)-2-butyl-5-pent-4-enyl-pyrrolidine-1-carboxylic acid benzyl ester Formula: C21H31NO2 MolecularWeight: 329.47634

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(N1C(=O)OCC2=CC=CC=C2)CCCC=C

Isomeric SMILES

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

InChI

InChI=1S/C21H31NO2/c1-3-5-8-14-20-16-15-19(13-6-4-2)22(20)21(23)24-17-18-11-9-7-10-12-18/h3,7,9-12,19-20H,1,4-6,8,13-17H2,2H3/t19-,20+/m1/s1