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

Systemtic Name: N-(3-methyl-2-morpholin-4-yl-butyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-(3-methyl-2-morpholino-butyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-[3-methyl-2-(4-morpholinyl)butyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-(3-methyl-2-morpholin-4-ylbutyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-(3-methyl-2-morpholino-butyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C18H28N2O5S MolecularWeight: 384.49032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H28N2O5S/c1-14(2)16(20-6-10-23-11-7-20)13-19-26(21,22)15-4-5-17-18(12-15)25-9-3-8-24-17/h4-5,12,14,16,19H,3,6-11,13H2,1-2H3