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

Systemtic Name: N,N-diethyl-4-[(2-methoxypyridin-3-yl)methylamino]-3-nitro-benzenesulfonamide Openeye Name: N,N-diethyl-4-[(2-methoxy-3-pyridyl)methylamino]-3-nitro-benzenesulfonamide CAS Name: N,N-diethyl-4-[(2-methoxy-3-pyridinyl)methylamino]-3-nitrobenzenesulfonamide IUPAC Name: N,N-diethyl-4-[(2-methoxypyridin-3-yl)methylamino]-3-nitrobenzenesulfonamide Traditional Name: N,N-diethyl-4-[(2-methoxy-3-pyridyl)methylamino]-3-nitro-benzenesulfonamide Formula: C17H22N4O5S MolecularWeight: 394.44538

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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)OC)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C17H22N4O5S/c1-4-20(5-2)27(24,25)14-8-9-15(16(11-14)21(22)23)19-12-13-7-6-10-18-17(13)26-3/h6-11,19H,4-5,12H2,1-3H3