(2S,3S)-3-methyl-2-(4-phenylbutanoylamino)pentanoate

Systemtic Name: (2S,3S)-3-methyl-2-(4-phenylbutanoylamino)pentanoate Openeye Name: (2S,3S)-3-methyl-2-(4-phenylbutanoylamino)pentanoate CAS Name: (2S,3S)-3-methyl-2-[(1-oxo-4-phenylbutyl)amino]pentanoate IUPAC Name: (2S,3S)-3-methyl-2-(4-phenylbutanoylamino)pentanoate Traditional Name: (2S,3S)-3-methyl-2-(4-phenylbutanoylamino)valerate Formula: C16H22NO3- MolecularWeight: 276.35078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)[O-])NC(=O)CCCC1=CC=CC=C1

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)[O-])NC(=O)CCCC1=CC=CC=C1

InChI

InChI=1S/C16H23NO3/c1-3-12(2)15(16(19)20)17-14(18)11-7-10-13-8-5-4-6-9-13/h4-6,8-9,12,15H,3,7,10-11H2,1-2H3,(H,17,18)(H,19,20)/p-1/t12-,15-/m0/s1