tert-butyl (1R,2S,5S)-2-acetyloxy-5-[[(1S)-1-phenylethyl]-(phenylmethyl)amino]cyclopentane-1-carboxylate

Systemtic Name: tert-butyl (1R,2S,5S)-2-acetyloxy-5-[[(1S)-1-phenylethyl]-(phenylmethyl)amino]cyclopentane-1-carboxylate Openeye Name: tert-butyl (1R,2S,5S)-2-acetoxy-5-[benzyl-[(1S)-1-phenylethyl]amino]cyclopentanecarboxylate CAS Name: (1R,2S,5S)-2-acetyloxy-5-[[(1S)-1-phenylethyl]-(phenylmethyl)amino]-1-cyclopentanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (1R,2S,5S)-2-acetyloxy-5-[benzyl-[(1S)-1-phenylethyl]amino]cyclopentane-1-carboxylate Traditional Name: (1R,2S,5S)-2-acetoxy-5-[benzyl-[(1S)-1-phenylethyl]amino]cyclopentanecarboxylic acid tert-butyl ester Formula: C27H35NO4 MolecularWeight: 437.5711

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N(CC2=CC=CC=C2)C3CCC(C3C(=O)OC(C)(C)C)OC(=O)C

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)N(CC2=CC=CC=C2)[C@H]3CC[C@@H]([C@@H]3C(=O)OC(C)(C)C)OC(=O)C

InChI

InChI=1S/C27H35NO4/c1-19(22-14-10-7-11-15-22)28(18-21-12-8-6-9-13-21)23-16-17-24(31-20(2)29)25(23)26(30)32-27(3,4)5/h6-15,19,23-25H,16-18H2,1-5H3/t19-,23-,24-,25+/m0/s1