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

Systemtic Name: 7-isothiocyanato-3,4-dihydro-2H-1,5-benzodioxepine Openeye Name: 7-isothiocyanato-3,4-dihydro-2H-1,5-benzodioxepine CAS Name: 7-isothiocyanato-3,4-dihydro-2H-1,5-benzodioxepin IUPAC Name: 7-isothiocyanato-3,4-dihydro-2H-1,5-benzodioxepine Traditional Name: 7-isothiocyanato-3,4-dihydro-2H-1,5-benzodioxepin Formula: C10H9NO2S MolecularWeight: 207.24896

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H9NO2S/c14-7-11-8-2-3-9-10(6-8)13-5-1-4-12-9/h2-3,6H,1,4-5H2