tert-butyl (1S,2S,3R)-3-methyl-2-[methyl-[(1S)-1-phenylethyl]amino]cyclopentane-1-carboxylate

Systemtic Name: tert-butyl (1S,2S,3R)-3-methyl-2-[methyl-[(1S)-1-phenylethyl]amino]cyclopentane-1-carboxylate Openeye Name: tert-butyl (1S,2S,3R)-3-methyl-2-[methyl-[(1S)-1-phenylethyl]amino]cyclopentanecarboxylate CAS Name: (1S,2S,3R)-3-methyl-2-[methyl-[(1S)-1-phenylethyl]amino]-1-cyclopentanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (1S,2S,3R)-3-methyl-2-[methyl-[(1S)-1-phenylethyl]amino]cyclopentane-1-carboxylate Traditional Name: (1S,2S,3R)-3-methyl-2-[methyl-[(1S)-1-phenylethyl]amino]cyclopentanecarboxylic acid tert-butyl ester Formula: C20H31NO2 MolecularWeight: 317.46564

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C1N(C)C(C)C2=CC=CC=C2)C(=O)OC(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C20H31NO2/c1-14-12-13-17(19(22)23-20(3,4)5)18(14)21(6)15(2)16-10-8-7-9-11-16/h7-11,14-15,17-18H,12-13H2,1-6H3/t14-,15+,17+,18+/m1/s1