(2S)-2-[[(2R)-2-(acetyloxymethyl)-3-naphthalen-1-yl-propanoyl]amino]hexanoic acid

Systemtic Name: (2S)-2-[[(2R)-2-(acetyloxymethyl)-3-naphthalen-1-yl-propanoyl]amino]hexanoic acid Openeye Name: (2S)-2-[[(2R)-2-(acetoxymethyl)-3-(1-naphthyl)propanoyl]amino]hexanoic acid CAS Name: (2S)-2-[[(2R)-2-(acetyloxymethyl)-3-(1-naphthalenyl)-1-oxopropyl]amino]hexanoic acid IUPAC Name: (2S)-2-[[(2R)-2-(acetyloxymethyl)-3-naphthalen-1-ylpropanoyl]amino]hexanoic acid Traditional Name: (2S)-2-[[(2R)-2-(acetoxymethyl)-3-(1-naphthyl)propanoyl]amino]hexanoic acid Formula: C22H27NO5 MolecularWeight: 385.45348

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27NO5/c1-3-4-12-20(22(26)27)23-21(25)18(14-28-15(2)24)13-17-10-7-9-16-8-5-6-11-19(16)17/h5-11,18,20H,3-4,12-14H2,1-2H3,(H,23,25)(H,26,27)/t18-,20+/m1/s1