2-acetyloxy-2-(4-azanyl-2-carboxy-phenyl)propanoate

Systemtic Name: 2-acetyloxy-2-(4-azanyl-2-carboxy-phenyl)propanoate Openeye Name: 2-acetoxy-2-(4-amino-2-carboxy-phenyl)propanoate CAS Name: 2-acetyloxy-2-(4-amino-2-carboxyphenyl)propanoate IUPAC Name: 2-acetyloxy-2-(4-amino-2-carboxyphenyl)propanoate Traditional Name: 2-acetoxy-2-(4-amino-2-carboxy-phenyl)propionate Formula: C12H12NO6- MolecularWeight: 266.22678

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C)(C1=C(C=C(C=C1)N)C(=O)O)C(=O)[O-]

Isomeric SMILES

CC(=O)OC(C)(C1=C(C=C(C=C1)N)C(=O)O)C(=O)[O-]

InChI

InChI=1S/C12H13NO6/c1-6(14)19-12(2,11(17)18)9-4-3-7(13)5-8(9)10(15)16/h3-5H,13H2,1-2H3,(H,15,16)(H,17,18)/p-1