[4-(2-oxidanylideneethyl)phenyl]methyl (2S)-2-azanylpropanoate

Systemtic Name: [4-(2-oxidanylideneethyl)phenyl]methyl (2S)-2-azanylpropanoate Openeye Name: [4-(2-oxoethyl)phenyl]methyl (2S)-2-aminopropanoate CAS Name: (2S)-2-aminopropanoic acid [4-(2-oxoethyl)phenyl]methyl ester IUPAC Name: [4-(2-oxoethyl)phenyl]methyl (2S)-2-aminopropanoate Traditional Name: (2S)-2-aminopropionic acid [4-(2-ketoethyl)benzyl] ester Formula: C12H15NO3 MolecularWeight: 221.2524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=CC=C(C=C1)CC=O)N

Isomeric SMILES

C[C@@H](C(=O)OCC1=CC=C(C=C1)CC=O)N

InChI

InChI=1S/C12H15NO3/c1-9(13)12(15)16-8-11-4-2-10(3-5-11)6-7-14/h2-5,7,9H,6,8,13H2,1H3/t9-/m0/s1