2-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylsulfonyl]propanamide

Systemtic Name: 2-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylsulfonyl]propanamide Openeye Name: 2-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylsulfonyl]propanamide CAS Name: 2-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylsulfonyl]propanamide IUPAC Name: 2-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylsulfonyl]propanamide Traditional Name: 2-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylsulfonyl]propionamide Formula: C13H16ClNO5S MolecularWeight: 333.78784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)S(=O)(=O)CC1=CC2=C(C(=C1)Cl)OCCCO2

Isomeric SMILES

CC(C(=O)N)S(=O)(=O)CC1=CC2=C(C(=C1)Cl)OCCCO2

InChI

InChI=1S/C13H16ClNO5S/c1-8(13(15)16)21(17,18)7-9-5-10(14)12-11(6-9)19-3-2-4-20-12/h5-6,8H,2-4,7H2,1H3,(H2,15,16)