1-(3,5-dimethoxyphenyl)-3,4-bis(2-hydroxyethylsulfanyl)pyrrole-2,5-dione

Systemtic Name: 1-(3,5-dimethoxyphenyl)-3,4-bis(2-hydroxyethylsulfanyl)pyrrole-2,5-dione Openeye Name: 1-(3,5-dimethoxyphenyl)-3,4-bis(2-hydroxyethylsulfanyl)pyrrole-2,5-dione CAS Name: 1-(3,5-dimethoxyphenyl)-3,4-bis(2-hydroxyethylthio)pyrrole-2,5-dione IUPAC Name: 1-(3,5-dimethoxyphenyl)-3,4-bis(2-hydroxyethylsulfanyl)pyrrole-2,5-dione Traditional Name: 1-(3,5-dimethoxyphenyl)-3,4-bis(2-hydroxyethylthio)-3-pyrroline-2,5-quinone Formula: C16H19NO6S2 MolecularWeight: 385.45516

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)N2C(=O)C(=C(C2=O)SCCO)SCCO)OC

Isomeric SMILES

COC1=CC(=CC(=C1)N2C(=O)C(=C(C2=O)SCCO)SCCO)OC

InChI

InChI=1S/C16H19NO6S2/c1-22-11-7-10(8-12(9-11)23-2)17-15(20)13(24-5-3-18)14(16(17)21)25-6-4-19/h7-9,18-19H,3-6H2,1-2H3