barium(2+); methanal; diphenoxide

Systemtic Name: barium(2+); methanal; diphenoxide Openeye Name: barium(2+); formaldehyde; diphenoxide CAS Name: barium(2+); formaldehyde; diphenoxide IUPAC Name: barium(2+); formaldehyde; diphenoxide Traditional Name: barium(2+); formaldehyde; diphenoxide Formula: C13H12BaO3 MolecularWeight: 353.55958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C6H6O.CH2O.Ba/c2*7-6-4-2-1-3-5-6;1-2;/h2*1-5,7H;1H2;/q;;;+2/p-2