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4-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(methyl)amino]-N,N-diethyl-3-nitro-benzenesulfonamide

4-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(methyl)amino]-N,N-diethyl-3-nitro-benzenesulfonamide

Systemtic Name:4-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(methyl)amino]-N,N-diethyl-3-nitro-benzenesulfonamide
Openeye Name:4-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(methyl)amino]-N,N-diethyl-3-nitro-benzenesulfonamide
CAS Name:4-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(methyl)amino]-N,N-diethyl-3-nitrobenzenesulfonamide
IUPAC Name:4-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(methyl)amino]-N,N-diethyl-3-nitrobenzenesulfonamide
Traditional Name:4-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(methyl)amino]-N,N-diethyl-3-nitro-benzenesulfonamide
Formula: C20H25N3O6S
MolecularWeight: 435.494
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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N(C)CC2=CC3=C(C=C2)OCCO3)[N+](=O)[O-]


Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N(C)CC2=CC3=C(C=C2)OCCO3)[N+](=O)[O-]


InChI

InChI=1S/C20H25N3O6S/c1-4-22(5-2)30(26,27)16-7-8-17(18(13-16)23(24)25)21(3)14-15-6-9-19-20(12-15)29-11-10-28-19/h6-9,12-13H,4-5,10-11,14H2,1-3H3


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