4-[(2-ethoxypyridin-3-yl)methylamino]-N,N-diethyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-[(2-ethoxypyridin-3-yl)methylamino]-N,N-diethyl-3-nitro-benzenesulfonamide Openeye Name: 4-[(2-ethoxy-3-pyridyl)methylamino]-N,N-diethyl-3-nitro-benzenesulfonamide CAS Name: 4-[(2-ethoxy-3-pyridinyl)methylamino]-N,N-diethyl-3-nitrobenzenesulfonamide IUPAC Name: 4-[(2-ethoxypyridin-3-yl)methylamino]-N,N-diethyl-3-nitrobenzenesulfonamide Traditional Name: 4-[(2-ethoxy-3-pyridyl)methylamino]-N,N-diethyl-3-nitro-benzenesulfonamide Formula: C18H24N4O5S MolecularWeight: 408.47196

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NCC2=C(N=CC=C2)OCC)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NCC2=C(N=CC=C2)OCC)[N+](=O)[O-]

InChI

InChI=1S/C18H24N4O5S/c1-4-21(5-2)28(25,26)15-9-10-16(17(12-15)22(23)24)20-13-14-8-7-11-19-18(14)27-6-3/h7-12,20H,4-6,13H2,1-3H3