tert-butyl (3S,4R,5R)-4,5-bis(oxidanyl)-3-[[(1R)-1-phenylethyl]-(phenylmethyl)amino]hexanoate

Systemtic Name: tert-butyl (3S,4R,5R)-4,5-bis(oxidanyl)-3-[[(1R)-1-phenylethyl]-(phenylmethyl)amino]hexanoate Openeye Name: tert-butyl (3S,4R,5R)-3-[benzyl-[(1R)-1-phenylethyl]amino]-4,5-dihydroxy-hexanoate CAS Name: (3S,4R,5R)-4,5-dihydroxy-3-[[(1R)-1-phenylethyl]-(phenylmethyl)amino]hexanoic acid tert-butyl ester IUPAC Name: tert-butyl (3S,4R,5R)-3-[benzyl-[(1R)-1-phenylethyl]amino]-4,5-dihydroxyhexanoate Traditional Name: (3S,4R,5R)-3-[benzyl-[(1R)-1-phenylethyl]amino]-4,5-dihydroxy-hexanoic acid tert-butyl ester Formula: C25H35NO4 MolecularWeight: 413.5497

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H35NO4/c1-18(21-14-10-7-11-15-21)26(17-20-12-8-6-9-13-20)22(24(29)19(2)27)16-23(28)30-25(3,4)5/h6-15,18-19,22,24,27,29H,16-17H2,1-5H3/t18-,19-,22+,24+/m1/s1