6-[2,3-dihydro-1,4-benzodioxin-6-yl-(2-isothiocyanatophenyl)methyl]-2,3-dihydro-1,4-benzodioxine

Systemtic Name: 6-[2,3-dihydro-1,4-benzodioxin-6-yl-(2-isothiocyanatophenyl)methyl]-2,3-dihydro-1,4-benzodioxine Openeye Name: 6-[2,3-dihydro-1,4-benzodioxin-6-yl-(2-isothiocyanatophenyl)methyl]-2,3-dihydro-1,4-benzodioxine CAS Name: 6-[2,3-dihydro-1,4-benzodioxin-6-yl-(2-isothiocyanatophenyl)methyl]-2,3-dihydro-1,4-benzodioxin IUPAC Name: 6-[2,3-dihydro-1,4-benzodioxin-6-yl-(2-isothiocyanatophenyl)methyl]-2,3-dihydro-1,4-benzodioxine Traditional Name: 6-[2,3-dihydro-1,4-benzodioxin-6-yl-(2-isothiocyanatophenyl)methyl]-2,3-dihydro-1,4-benzodioxin Formula: C24H19NO4S MolecularWeight: 417.47696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C(C3=CC4=C(C=C3)OCCO4)C5=CC=CC=C5N=C=S

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C(C3=CC4=C(C=C3)OCCO4)C5=CC=CC=C5N=C=S

InChI

InChI=1S/C24H19NO4S/c30-15-25-19-4-2-1-3-18(19)24(16-5-7-20-22(13-16)28-11-9-26-20)17-6-8-21-23(14-17)29-12-10-27-21/h1-8,13-14,24H,9-12H2