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

Systemtic Name: tert-butyl (1S,2S,3S)-2-[methyl-[(1S)-1-phenylethyl]amino]-3-propan-2-yl-cyclopentane-1-carboxylate Openeye Name: tert-butyl (1S,2S,3S)-3-isopropyl-2-[methyl-[(1S)-1-phenylethyl]amino]cyclopentanecarboxylate CAS Name: (1S,2S,3S)-2-[methyl-[(1S)-1-phenylethyl]amino]-3-propan-2-yl-1-cyclopentanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (1S,2S,3S)-2-[methyl-[(1S)-1-phenylethyl]amino]-3-propan-2-ylcyclopentane-1-carboxylate Traditional Name: (1S,2S,3S)-3-isopropyl-2-[methyl-[(1S)-1-phenylethyl]amino]cyclopentanecarboxylic acid tert-butyl ester Formula: C22H35NO2 MolecularWeight: 345.5188

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1CCC(C1N(C)C(C)C2=CC=CC=C2)C(=O)OC(C)(C)C

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)N(C)[C@H]2[C@@H](CC[C@@H]2C(=O)OC(C)(C)C)C(C)C

InChI

InChI=1S/C22H35NO2/c1-15(2)18-13-14-19(21(24)25-22(4,5)6)20(18)23(7)16(3)17-11-9-8-10-12-17/h8-12,15-16,18-20H,13-14H2,1-7H3/t16-,18-,19-,20-/m0/s1