tert-butyl (2R,3R)-5-methyl-2-oxidanyl-3-[[(1R)-1-phenylethyl]-(phenylmethyl)amino]hexanoate

Systemtic Name: tert-butyl (2R,3R)-5-methyl-2-oxidanyl-3-[[(1R)-1-phenylethyl]-(phenylmethyl)amino]hexanoate Openeye Name: tert-butyl (2R,3R)-3-[benzyl-[(1R)-1-phenylethyl]amino]-2-hydroxy-5-methyl-hexanoate CAS Name: (2R,3R)-2-hydroxy-5-methyl-3-[[(1R)-1-phenylethyl]-(phenylmethyl)amino]hexanoic acid tert-butyl ester IUPAC Name: tert-butyl (2R,3R)-3-[benzyl-[(1R)-1-phenylethyl]amino]-2-hydroxy-5-methylhexanoate Traditional Name: (2R,3R)-3-[benzyl-[(1R)-1-phenylethyl]amino]-2-hydroxy-5-methyl-hexanoic acid tert-butyl ester Formula: C26H37NO3 MolecularWeight: 411.57688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(C(=O)OC(C)(C)C)O)N(CC1=CC=CC=C1)C(C)C2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C26H37NO3/c1-19(2)17-23(24(28)25(29)30-26(4,5)6)27(18-21-13-9-7-10-14-21)20(3)22-15-11-8-12-16-22/h7-16,19-20,23-24,28H,17-18H2,1-6H3/t20-,23-,24-/m1/s1