methyl (2S)-2-(butanoylamino)-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-(butanoylamino)-3-phenyl-propanoate Openeye Name: methyl (2S)-2-(butanoylamino)-3-phenyl-propanoate CAS Name: (2S)-2-(1-oxobutylamino)-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-(butanoylamino)-3-phenylpropanoate Traditional Name: (2S)-2-butyramido-3-phenyl-propionic acid methyl ester Formula: C14H19NO3 MolecularWeight: 249.30556

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19NO3/c1-3-7-13(16)15-12(14(17)18-2)10-11-8-5-4-6-9-11/h4-6,8-9,12H,3,7,10H2,1-2H3,(H,15,16)/t12-/m0/s1