calcium; 2-acetyloxybenzoate; 2-azanylethanoate

Systemtic Name: calcium; 2-acetyloxybenzoate; 2-azanylethanoate Openeye Name: calcium; 2-acetoxybenzoate; 2-aminoacetate CAS Name: calcium; 2-acetyloxybenzoate; 2-aminoacetate IUPAC Name: calcium; 2-acetyloxybenzoate; 2-aminoacetate Traditional Name: calcium; 2-acetoxybenzoate; 2-aminoacetate Formula: C11H11CaNO6 MolecularWeight: 293.28614

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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/p-2