3,4-dihydro-2H-1,5-benzodioxepine-7-thiol

Systemtic Name: 3,4-dihydro-2H-1,5-benzodioxepine-7-thiol Openeye Name: 3,4-dihydro-2H-1,5-benzodioxepine-7-thiol CAS Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-thiol IUPAC Name: 3,4-dihydro-2H-1,5-benzodioxepine-7-thiol Traditional Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-thiol Formula: C9H10O2S MolecularWeight: 182.2395

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)S)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)S)OC1

InChI

InChI=1S/C9H10O2S/c12-7-2-3-8-9(6-7)11-5-1-4-10-8/h2-3,6,12H,1,4-5H2