methylsulfinylmethane; 4-oxidanylidene-2-(4-phenylmethoxyphenyl)chromen-3-olate; ruthenium(2+)

Systemtic Name: methylsulfinylmethane; 4-oxidanylidene-2-(4-phenylmethoxyphenyl)chromen-3-olate; ruthenium(2+) Openeye Name: 2-(4-benzyloxyphenyl)-4-oxo-chromen-3-olate; methylsulfinylmethane; ruthenium(2+) CAS Name: methylsulfinylmethane; 4-oxo-2-(4-phenylmethoxyphenyl)-1-benzopyran-3-olate; ruthenium(2+) IUPAC Name: methylsulfinylmethane; 4-oxo-2-(4-phenylmethoxyphenyl)chromen-3-olate; ruthenium(2+) Traditional Name: 2-(4-benzoxyphenyl)-4-keto-chromen-3-olate; methylsulfinylmethane; ruthenium(2+) Formula: C48H42O10RuS2 MolecularWeight: 944.04108

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)C.CS(=O)C.C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=C(C(=O)C4=CC=CC=C4O3)[O-].C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=C(C(=O)C4=CC=CC=C4O3)[O-].[Ru+2]

Isomeric SMILES

CS(=O)C.CS(=O)C.C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=C(C(=O)C4=CC=CC=C4O3)[O-].C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=C(C(=O)C4=CC=CC=C4O3)[O-].[Ru+2]

InChI

InChI=1S/2C22H16O4.2C2H6OS.Ru/c2*23-20-18-8-4-5-9-19(18)26-22(21(20)24)16-10-12-17(13-11-16)25-14-15-6-2-1-3-7-15;2*1-4(2)3;/h2*1-13,24H,14H2;2*1-2H3;/q;;;;+2/p-2