N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-3-morpholin-4-ylcarbonyl-benzenesulfonamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-3-morpholin-4-ylcarbonyl-benzenesulfonamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-3-(morpholine-4-carbonyl)benzenesulfonamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-3-[4-morpholinyl(oxo)methyl]benzenesulfonamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-3-(morpholine-4-carbonyl)benzenesulfonamide Traditional Name: 4-methoxy-3-(morpholine-4-carbonyl)-N-piperonyl-benzenesulfonamide Formula: C20H22N2O7S MolecularWeight: 434.46288

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC3=C(C=C2)OCO3)C(=O)N4CCOCC4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC3=C(C=C2)OCO3)C(=O)N4CCOCC4

InChI

InChI=1S/C20H22N2O7S/c1-26-17-5-3-15(11-16(17)20(23)22-6-8-27-9-7-22)30(24,25)21-12-14-2-4-18-19(10-14)29-13-28-18/h2-5,10-11,21H,6-9,12-13H2,1H3