dicalcium diphenoxide sulfite

Systemtic Name: dicalcium diphenoxide sulfite Openeye Name: dicalcium diphenoxide sulfite CAS Name: dicalcium diphenoxide sulfite IUPAC Name: dicalcium diphenoxide sulfite Traditional Name: dicalcium diphenoxide sulfite Formula: C12H10Ca2O5S MolecularWeight: 346.4258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[O-].C1=CC=C(C=C1)[O-].[O-]S(=O)[O-].[Ca+2].[Ca+2]

Isomeric SMILES

C1=CC=C(C=C1)[O-].C1=CC=C(C=C1)[O-].[O-]S(=O)[O-].[Ca+2].[Ca+2]

InChI

InChI=1S/2C6H6O.2Ca.H2O3S/c2*7-6-4-2-1-3-5-6;;;1-4(2)3/h2*1-5,7H;;;(H2,1,2,3)/q;;2*+2;/p-4