tert-butyl (3S)-3-[[[(1R)-1-phenylethyl]amino]methyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (3S)-3-[[[(1R)-1-phenylethyl]amino]methyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl (3S)-3-[[[(1R)-1-phenylethyl]amino]methyl]pyrrolidine-1-carboxylate CAS Name: (3S)-3-[[[(1R)-1-phenylethyl]amino]methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3S)-3-[[[(1R)-1-phenylethyl]amino]methyl]pyrrolidine-1-carboxylate Traditional Name: (3S)-3-[[[(1R)-1-phenylethyl]amino]methyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C18H28N2O2 MolecularWeight: 304.42712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NCC2CCN(C2)C(=O)OC(C)(C)C

Isomeric SMILES

C[C@H](C1=CC=CC=C1)NC[C@@H]2CCN(C2)C(=O)OC(C)(C)C

InChI

InChI=1S/C18H28N2O2/c1-14(16-8-6-5-7-9-16)19-12-15-10-11-20(13-15)17(21)22-18(2,3)4/h5-9,14-15,19H,10-13H2,1-4H3/t14-,15+/m1/s1