N-[(4-ethoxy-3-methoxy-phenyl)methyl]-N,2-dimethyl-5-nitro-benzenesulfonamide

Systemtic Name: N-[(4-ethoxy-3-methoxy-phenyl)methyl]-N,2-dimethyl-5-nitro-benzenesulfonamide Openeye Name: N-[(4-ethoxy-3-methoxy-phenyl)methyl]-N,2-dimethyl-5-nitro-benzenesulfonamide CAS Name: N-[(4-ethoxy-3-methoxyphenyl)methyl]-N,2-dimethyl-5-nitrobenzenesulfonamide IUPAC Name: N-[(4-ethoxy-3-methoxyphenyl)methyl]-N,2-dimethyl-5-nitrobenzenesulfonamide Traditional Name: N-(4-ethoxy-3-methoxy-benzyl)-N,2-dimethyl-5-nitro-benzenesulfonamide Formula: C18H22N2O6S MolecularWeight: 394.44208

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CN(C)S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CN(C)S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])C)OC

InChI

InChI=1S/C18H22N2O6S/c1-5-26-16-9-7-14(10-17(16)25-4)12-19(3)27(23,24)18-11-15(20(21)22)8-6-13(18)2/h6-11H,5,12H2,1-4H3