tert-butyl (2S)-2-[[(2S)-2-(acetyloxymethyl)-3-naphthalen-1-yl-propanoyl]amino]hexanoate

Systemtic Name: tert-butyl (2S)-2-[[(2S)-2-(acetyloxymethyl)-3-naphthalen-1-yl-propanoyl]amino]hexanoate Openeye Name: tert-butyl (2S)-2-[[(2S)-2-(acetoxymethyl)-3-(1-naphthyl)propanoyl]amino]hexanoate CAS Name: (2S)-2-[[(2S)-2-(acetyloxymethyl)-3-(1-naphthalenyl)-1-oxopropyl]amino]hexanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[[(2S)-2-(acetyloxymethyl)-3-naphthalen-1-ylpropanoyl]amino]hexanoate Traditional Name: (2S)-2-[[(2S)-2-(acetoxymethyl)-3-(1-naphthyl)propanoyl]amino]hexanoic acid tert-butyl ester Formula: C26H35NO5 MolecularWeight: 441.5598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OC(C)(C)C)NC(=O)C(CC1=CC=CC2=CC=CC=C21)COC(=O)C

Isomeric SMILES

CCCC[C@@H](C(=O)OC(C)(C)C)NC(=O)[C@@H](CC1=CC=CC2=CC=CC=C21)COC(=O)C

InChI

InChI=1S/C26H35NO5/c1-6-7-15-23(25(30)32-26(3,4)5)27-24(29)21(17-31-18(2)28)16-20-13-10-12-19-11-8-9-14-22(19)20/h8-14,21,23H,6-7,15-17H2,1-5H3,(H,27,29)/t21-,23-/m0/s1