4,4-bis(3,4-dimethoxyphenyl)-3,1-benzoxathiin-2-one

Systemtic Name: 4,4-bis(3,4-dimethoxyphenyl)-3,1-benzoxathiin-2-one Openeye Name: 4,4-bis(3,4-dimethoxyphenyl)-3,1-benzoxathiin-2-one CAS Name: 4,4-bis(3,4-dimethoxyphenyl)-3,1-benzoxathiin-2-one IUPAC Name: 4,4-bis(3,4-dimethoxyphenyl)-3,1-benzoxathiin-2-one Traditional Name: 4,4-bis(3,4-dimethoxyphenyl)-3,1-benzoxathiin-2-one Formula: C24H22O6S MolecularWeight: 438.49288

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(C3=CC=CC=C3SC(=O)O2)C4=CC(=C(C=C4)OC)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2(C3=CC=CC=C3SC(=O)O2)C4=CC(=C(C=C4)OC)OC)OC

InChI

InChI=1S/C24H22O6S/c1-26-18-11-9-15(13-20(18)28-3)24(16-10-12-19(27-2)21(14-16)29-4)17-7-5-6-8-22(17)31-23(25)30-24/h5-14H,1-4H3