N,N-diethyl-4-[(3-fluoranyl-4-methoxy-phenyl)methyl-methyl-amino]-3-nitro-benzenesulfonamide

Systemtic Name: N,N-diethyl-4-[(3-fluoranyl-4-methoxy-phenyl)methyl-methyl-amino]-3-nitro-benzenesulfonamide Openeye Name: N,N-diethyl-4-[(3-fluoro-4-methoxy-phenyl)methyl-methyl-amino]-3-nitro-benzenesulfonamide CAS Name: N,N-diethyl-4-[(3-fluoro-4-methoxyphenyl)methyl-methylamino]-3-nitrobenzenesulfonamide IUPAC Name: N,N-diethyl-4-[(3-fluoro-4-methoxyphenyl)methyl-methylamino]-3-nitrobenzenesulfonamide Traditional Name: N,N-diethyl-4-[(3-fluoro-4-methoxy-benzyl)-methyl-amino]-3-nitro-benzenesulfonamide Formula: C19H24FN3O5S MolecularWeight: 425.474363

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24FN3O5S/c1-5-22(6-2)29(26,27)15-8-9-17(18(12-15)23(24)25)21(3)13-14-7-10-19(28-4)16(20)11-14/h7-12H,5-6,13H2,1-4H3