N-[5-chloranyl-2-(dimethylamino)phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide

Systemtic Name: N-[5-chloranyl-2-(dimethylamino)phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-[5-chloro-2-(dimethylamino)phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-[5-chloro-2-(dimethylamino)phenyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-[5-chloro-2-(dimethylamino)phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-[5-chloro-2-(dimethylamino)phenyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C17H19ClN2O4S MolecularWeight: 382.86176

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)Cl)NS(=O)(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)Cl)NS(=O)(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C17H19ClN2O4S/c1-20(2)15-6-4-12(18)10-14(15)19-25(21,22)13-5-7-16-17(11-13)24-9-3-8-23-16/h4-7,10-11,19H,3,8-9H2,1-2H3