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

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-5-nitro-benzenesulfonamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-5-nitro-benzenesulfonamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-5-nitrobenzenesulfonamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-5-nitrobenzenesulfonamide Traditional Name: N-homoveratryl-2-methyl-5-nitro-benzenesulfonamide Formula: C17H20N2O6S MolecularWeight: 380.4155

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C17H20N2O6S/c1-12-4-6-14(19(20)21)11-17(12)26(22,23)18-9-8-13-5-7-15(24-2)16(10-13)25-3/h4-7,10-11,18H,8-9H2,1-3H3