3-methoxy-3,4-dihydro-2H-[1,4]dithiepino[2,3-c]pyrrole-6,8-dione

Systemtic Name: 3-methoxy-3,4-dihydro-2H-[1,4]dithiepino[2,3-c]pyrrole-6,8-dione Openeye Name: 3-methoxy-3,4-dihydro-2H-[1,4]dithiepino[2,3-c]pyrrole-6,8-dione CAS Name: 3-methoxy-3,4-dihydro-2H-[1,4]dithiepino[2,3-c]pyrrole-6,8-dione IUPAC Name: 3-methoxy-3,4-dihydro-2H-[1,4]dithiepino[2,3-c]pyrrole-6,8-dione Traditional Name: 3-methoxy-3,4-dihydro-2H-[1,4]dithiepino[2,3-c]pyrrole-6,8-quinone Formula: C8H9NO3S2 MolecularWeight: 231.29196

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Descriptors Computed from Structure

Canonical SMILES:

COC1CSC2=C(C(=O)NC2=O)SC1

Isomeric SMILES

COC1CSC2=C(C(=O)NC2=O)SC1

InChI

InChI=1S/C8H9NO3S2/c1-12-4-2-13-5-6(14-3-4)8(11)9-7(5)10/h4H,2-3H2,1H3,(H,9,10,11)