methyl (2S)-2-(3,3-dimethylbutanoylamino)-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-(3,3-dimethylbutanoylamino)-3-phenyl-propanoate Openeye Name: methyl (2S)-2-(3,3-dimethylbutanoylamino)-3-phenyl-propanoate CAS Name: (2S)-2-[(3,3-dimethyl-1-oxobutyl)amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-(3,3-dimethylbutanoylamino)-3-phenylpropanoate Traditional Name: (2S)-2-(3,3-dimethylbutanoylamino)-3-phenyl-propionic acid methyl ester Formula: C16H23NO3 MolecularWeight: 277.35872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)NC(CC1=CC=CC=C1)C(=O)OC

Isomeric SMILES

CC(C)(C)CC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)OC

InChI

InChI=1S/C16H23NO3/c1-16(2,3)11-14(18)17-13(15(19)20-4)10-12-8-6-5-7-9-12/h5-9,13H,10-11H2,1-4H3,(H,17,18)/t13-/m0/s1