N-[1-(3,4-dimethoxyphenyl)ethyl]-2-nitro-benzenesulfonamide

Systemtic Name: N-[1-(3,4-dimethoxyphenyl)ethyl]-2-nitro-benzenesulfonamide Openeye Name: N-[1-(3,4-dimethoxyphenyl)ethyl]-2-nitro-benzenesulfonamide CAS Name: N-[1-(3,4-dimethoxyphenyl)ethyl]-2-nitrobenzenesulfonamide IUPAC Name: N-[1-(3,4-dimethoxyphenyl)ethyl]-2-nitrobenzenesulfonamide Traditional Name: N-[1-(3,4-dimethoxyphenyl)ethyl]-2-nitro-benzenesulfonamide Formula: C16H18N2O6S MolecularWeight: 366.38892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)OC)OC)NS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC(=C(C=C1)OC)OC)NS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C16H18N2O6S/c1-11(12-8-9-14(23-2)15(10-12)24-3)17-25(21,22)16-7-5-4-6-13(16)18(19)20/h4-11,17H,1-3H3