phenyl (2S)-2-azanylpropanoate; propanedioic acid

Systemtic Name: phenyl (2S)-2-azanylpropanoate; propanedioic acid Openeye Name: malonic acid; phenyl (2S)-2-aminopropanoate CAS Name: (2S)-2-aminopropanoic acid phenyl ester; propanedioic acid IUPAC Name: phenyl (2S)-2-aminopropanoate; propanedioic acid Traditional Name: (2S)-2-aminopropionic acid phenyl ester; malonic acid Formula: C12H15NO6 MolecularWeight: 269.2506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC1=CC=CC=C1)N.C(C(=O)O)C(=O)O

Isomeric SMILES

C[C@@H](C(=O)OC1=CC=CC=C1)N.C(C(=O)O)C(=O)O

InChI

InChI=1S/C9H11NO2.C3H4O4/c1-7(10)9(11)12-8-5-3-2-4-6-8;4-2(5)1-3(6)7/h2-7H,10H2,1H3;1H2,(H,4,5)(H,6,7)/t7-;/m0./s1