S-(2-oxidanylideneethyl) 4-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]benzenecarbothioate

Systemtic Name: S-(2-oxidanylideneethyl) 4-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]benzenecarbothioate Openeye Name: S-(2-oxoethyl) 4-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]benzenecarbothioate CAS Name: 4-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]benzenecarbothioic acid S-(2-oxoethyl) ester IUPAC Name: S-(2-oxoethyl) 4-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]benzenecarbothioate Traditional Name: 4-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]thiobenzoic acid S-(2-ketoethyl) ester Formula: C31H28O5S MolecularWeight: 512.61602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)OCC4=CC=C(C=C4)C(=O)SCC=O

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)OCC4=CC=C(C=C4)C(=O)SCC=O

InChI

InChI=1S/C31H28O5S/c1-34-28-16-12-26(13-17-28)31(25-6-4-3-5-7-25,27-14-18-29(35-2)19-15-27)36-22-23-8-10-24(11-9-23)30(33)37-21-20-32/h3-20H,21-22H2,1-2H3