calcium 3-acetyloxy-4-methoxy-benzeneselenonate

Systemtic Name: calcium 3-acetyloxy-4-methoxy-benzeneselenonate Openeye Name: calcium 3-acetoxy-4-methoxy-benzeneselenonate CAS Name: calcium 3-acetyloxy-4-methoxybenzeneselenonate IUPAC Name: calcium 3-acetyloxy-4-methoxybenzeneselenonate Traditional Name: calcium 3-acetoxy-4-methoxy-benzeneselenonate Formula: C18H18CaO12Se2 MolecularWeight: 624.32632

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=CC(=C1)[Se](=O)(=O)[O-])OC.CC(=O)OC1=C(C=CC(=C1)[Se](=O)(=O)[O-])OC.[Ca+2]

Isomeric SMILES

CC(=O)OC1=C(C=CC(=C1)[Se](=O)(=O)[O-])OC.CC(=O)OC1=C(C=CC(=C1)[Se](=O)(=O)[O-])OC.[Ca+2]

InChI

InChI=1S/2C9H10O6Se.Ca/c2*1-6(10)15-9-5-7(16(11,12)13)3-4-8(9)14-2;/h2*3-5H,1-2H3,(H,11,12,13);/q;;+2/p-2