methyl 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)ethanoate

Systemtic Name: methyl 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)ethanoate Openeye Name: methyl 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)acetate CAS Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)acetic acid methyl ester IUPAC Name: methyl 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)acetate Traditional Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)acetic acid methyl ester Formula: C12H14O6S MolecularWeight: 286.30096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CS(=O)(=O)C1=CC2=C(C=C1)OCCCO2

Isomeric SMILES

COC(=O)CS(=O)(=O)C1=CC2=C(C=C1)OCCCO2

InChI

InChI=1S/C12H14O6S/c1-16-12(13)8-19(14,15)9-3-4-10-11(7-9)18-6-2-5-17-10/h3-4,7H,2,5-6,8H2,1H3