2-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethylamino)ethanesulfonamide

Systemtic Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethylamino)ethanesulfonamide Openeye Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethylamino)ethanesulfonamide CAS Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethylamino)ethanesulfonamide IUPAC Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethylamino)ethanesulfonamide Traditional Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethylamino)ethanesulfonamide Formula: C12H18N2O4S MolecularWeight: 286.34732

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC(=C2OC1)CNCCS(=O)(=O)N

Isomeric SMILES

C1COC2=CC=CC(=C2OC1)CNCCS(=O)(=O)N

InChI

InChI=1S/C12H18N2O4S/c13-19(15,16)8-5-14-9-10-3-1-4-11-12(10)18-7-2-6-17-11/h1,3-4,14H,2,5-9H2,(H2,13,15,16)