(2S)-2-azanyl-3-(4-propanoylphenyl)propanoic acid

Systemtic Name: (2S)-2-azanyl-3-(4-propanoylphenyl)propanoic acid Openeye Name: (2S)-2-amino-3-(4-propanoylphenyl)propanoic acid CAS Name: (2S)-2-amino-3-[4-(1-oxopropyl)phenyl]propanoic acid IUPAC Name: (2S)-2-amino-3-(4-propanoylphenyl)propanoic acid Traditional Name: (2S)-2-amino-3-(4-propionylphenyl)propionic acid Formula: C12H15NO3 MolecularWeight: 221.2524

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)CC(C(=O)O)N

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO3/c1-2-11(14)9-5-3-8(4-6-9)7-10(13)12(15)16/h3-6,10H,2,7,13H2,1H3,(H,15,16)/t10-/m0/s1