N,N-diethyl-4-[methyl(2-pyridin-2-ylethyl)amino]-3-nitro-benzenesulfonamide

Systemtic Name: N,N-diethyl-4-[methyl(2-pyridin-2-ylethyl)amino]-3-nitro-benzenesulfonamide Openeye Name: N,N-diethyl-4-[methyl-[2-(2-pyridyl)ethyl]amino]-3-nitro-benzenesulfonamide CAS Name: N,N-diethyl-4-[methyl-[2-(2-pyridinyl)ethyl]amino]-3-nitrobenzenesulfonamide IUPAC Name: N,N-diethyl-4-[methyl(2-pyridin-2-ylethyl)amino]-3-nitrobenzenesulfonamide Traditional Name: N,N-diethyl-4-[methyl-[2-(2-pyridyl)ethyl]amino]-3-nitro-benzenesulfonamide Formula: C18H24N4O4S MolecularWeight: 392.47256

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N(C)CCC2=CC=CC=N2)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N(C)CCC2=CC=CC=N2)[N+](=O)[O-]

InChI

InChI=1S/C18H24N4O4S/c1-4-21(5-2)27(25,26)16-9-10-17(18(14-16)22(23)24)20(3)13-11-15-8-6-7-12-19-15/h6-10,12,14H,4-5,11,13H2,1-3H3