N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2-methoxy-4-nitro-benzenesulfonamide

Systemtic Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2-methoxy-4-nitro-benzenesulfonamide Openeye Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2-methoxy-4-nitro-benzenesulfonamide CAS Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-2-methoxy-4-nitrobenzenesulfonamide IUPAC Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-2-methoxy-4-nitrobenzenesulfonamide Traditional Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2-methoxy-4-nitro-benzenesulfonamide Formula: C17H19N3O9S MolecularWeight: 441.41246

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])S(=O)(=O)NCCC2=CC(=C(C=C2[N+](=O)[O-])OC)OC

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])S(=O)(=O)NCCC2=CC(=C(C=C2[N+](=O)[O-])OC)OC

InChI

InChI=1S/C17H19N3O9S/c1-27-14-8-11(13(20(23)24)10-15(14)28-2)6-7-18-30(25,26)17-5-4-12(19(21)22)9-16(17)29-3/h4-5,8-10,18H,6-7H2,1-3H3