1,3-benzodioxol-5-ylmethyl-[2-[(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[2-[(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[2-(4-methoxy-3-morpholinosulfonyl-anilino)-2-oxo-ethyl]-methyl-ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[2-[4-methoxy-3-(4-morpholinylsulfonyl)anilino]-2-oxoethyl]-methylammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[2-(4-methoxy-3-morpholin-4-ylsulfonylanilino)-2-oxoethyl]-methylazanium Traditional Name: [2-keto-2-(4-methoxy-3-morpholinosulfonyl-anilino)ethyl]-methyl-piperonyl-ammonium Formula: C22H28N3O7S+ MolecularWeight: 478.53862

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC2=C(C=C1)OCO2)CC(=O)NC3=CC(=C(C=C3)OC)S(=O)(=O)N4CCOCC4

Isomeric SMILES

C[NH+](CC1=CC2=C(C=C1)OCO2)CC(=O)NC3=CC(=C(C=C3)OC)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H27N3O7S/c1-24(13-16-3-5-18-20(11-16)32-15-31-18)14-22(26)23-17-4-6-19(29-2)21(12-17)33(27,28)25-7-9-30-10-8-25/h3-6,11-12H,7-10,13-15H2,1-2H3,(H,23,26)/p+1