N4-[2-(5-methylfuran-2-yl)-2-morpholin-4-yl-ethyl]benzene-1,4-disulfonamide

Systemtic Name: N4-[2-(5-methylfuran-2-yl)-2-morpholin-4-yl-ethyl]benzene-1,4-disulfonamide Openeye Name: N4-[2-(5-methyl-2-furyl)-2-morpholino-ethyl]benzene-1,4-disulfonamide CAS Name: N4-[2-(5-methyl-2-furanyl)-2-(4-morpholinyl)ethyl]benzene-1,4-disulfonamide IUPAC Name: 4-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzene-1,4-disulfonamide Traditional Name: N'-[2-(5-methyl-2-furyl)-2-morpholino-ethyl]benzene-1,4-disulfonamide Formula: C17H23N3O6S2 MolecularWeight: 429.51102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C(CNS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N)N3CCOCC3

Isomeric SMILES

CC1=CC=C(O1)C(CNS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N)N3CCOCC3

InChI

InChI=1S/C17H23N3O6S2/c1-13-2-7-17(26-13)16(20-8-10-25-11-9-20)12-19-28(23,24)15-5-3-14(4-6-15)27(18,21)22/h2-7,16,19H,8-12H2,1H3,(H2,18,21,22)