methyl (3S,4S)-4-methyl-3-pentyl-1-[(1R)-1-phenylethyl]pyrrolidine-3-carboxylate

Systemtic Name: methyl (3S,4S)-4-methyl-3-pentyl-1-[(1R)-1-phenylethyl]pyrrolidine-3-carboxylate Openeye Name: methyl (3S,4S)-4-methyl-3-pentyl-1-[(1R)-1-phenylethyl]pyrrolidine-3-carboxylate CAS Name: (3S,4S)-4-methyl-3-pentyl-1-[(1R)-1-phenylethyl]-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (3S,4S)-4-methyl-3-pentyl-1-[(1R)-1-phenylethyl]pyrrolidine-3-carboxylate Traditional Name: (3S,4S)-3-amyl-4-methyl-1-[(1R)-1-phenylethyl]pyrrolidine-3-carboxylic acid methyl ester Formula: C20H31NO2 MolecularWeight: 317.46564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1(CN(CC1C)C(C)C2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CCCCC[C@]1(CN(C[C@H]1C)[C@H](C)C2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C20H31NO2/c1-5-6-10-13-20(19(22)23-4)15-21(14-16(20)2)17(3)18-11-8-7-9-12-18/h7-9,11-12,16-17H,5-6,10,13-15H2,1-4H3/t16-,17-,20-/m1/s1