calcium; 2-acetyloxybenzoic acid; 2-azanylethanoic acid

Systemtic Name: calcium; 2-acetyloxybenzoic acid; 2-azanylethanoic acid Openeye Name: calcium; 2-acetoxybenzoic acid; 2-aminoacetic acid CAS Name: calcium; 2-acetyloxybenzoic acid; 2-aminoacetic acid IUPAC Name: calcium; 2-acetyloxybenzoic acid; 2-aminoacetic acid Traditional Name: calcium; 2-acetoxybenzoic acid; 2-aminoacetic acid Formula: C11H13CaNO6+2 MolecularWeight: 295.30202

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC=C1C(=O)O.C(C(=O)O)N.[Ca+2]

Isomeric SMILES

CC(=O)OC1=CC=CC=C1C(=O)O.C(C(=O)O)N.[Ca+2]

InChI

InChI=1S/C9H8O4.C2H5NO2.Ca/c1-6(10)13-8-5-3-2-4-7(8)9(11)12;3-1-2(4)5;/h2-5H,1H3,(H,11,12);1,3H2,(H,4,5);/q;;+2