tert-butyl (3S)-5-methyl-3-[[(1S)-1-phenylethyl]-(phenylmethyl)amino]hexanoate

Systemtic Name: tert-butyl (3S)-5-methyl-3-[[(1S)-1-phenylethyl]-(phenylmethyl)amino]hexanoate Openeye Name: tert-butyl (3S)-3-[benzyl-[(1S)-1-phenylethyl]amino]-5-methyl-hexanoate CAS Name: (3S)-5-methyl-3-[[(1S)-1-phenylethyl]-(phenylmethyl)amino]hexanoic acid tert-butyl ester IUPAC Name: tert-butyl (3S)-3-[benzyl-[(1S)-1-phenylethyl]amino]-5-methylhexanoate Traditional Name: (3S)-3-[benzyl-[(1S)-1-phenylethyl]amino]-5-methyl-hexanoic acid tert-butyl ester Formula: C26H37NO2 MolecularWeight: 395.57748

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC(=O)OC(C)(C)C)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)CC(=O)OC(C)(C)C

InChI

InChI=1S/C26H37NO2/c1-20(2)17-24(18-25(28)29-26(4,5)6)27(19-22-13-9-7-10-14-22)21(3)23-15-11-8-12-16-23/h7-16,20-21,24H,17-19H2,1-6H3/t21-,24-/m0/s1