N-[(3,4-dimethoxyphenyl)methyl]-N,2,3-trimethyl-5-nitro-benzenesulfonamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-N,2,3-trimethyl-5-nitro-benzenesulfonamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-N,2,3-trimethyl-5-nitro-benzenesulfonamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-N,2,3-trimethyl-5-nitrobenzenesulfonamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-N,2,3-trimethyl-5-nitrobenzenesulfonamide Traditional Name: N,2,3-trimethyl-5-nitro-N-veratryl-benzenesulfonamide Formula: C18H22N2O6S MolecularWeight: 394.44208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)S(=O)(=O)N(C)CC2=CC(=C(C=C2)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1C)S(=O)(=O)N(C)CC2=CC(=C(C=C2)OC)OC)[N+](=O)[O-]

InChI

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