N-(3-ethyl-2-morpholin-4-yl-pentyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide

Systemtic Name: N-(3-ethyl-2-morpholin-4-yl-pentyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-(3-ethyl-2-morpholino-pentyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-[3-ethyl-2-(4-morpholinyl)pentyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-(3-ethyl-2-morpholin-4-ylpentyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-(3-ethyl-2-morpholino-pentyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C20H32N2O5S MolecularWeight: 412.54348

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(CNS(=O)(=O)C1=CC2=C(C=C1)OCCCO2)N3CCOCC3

Isomeric SMILES

CCC(CC)C(CNS(=O)(=O)C1=CC2=C(C=C1)OCCCO2)N3CCOCC3

InChI

InChI=1S/C20H32N2O5S/c1-3-16(4-2)18(22-8-12-25-13-9-22)15-21-28(23,24)17-6-7-19-20(14-17)27-11-5-10-26-19/h6-7,14,16,18,21H,3-5,8-13,15H2,1-2H3