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

Systemtic Name: N-[1-(3,4-diethoxyphenyl)ethyl]-4-nitro-benzenesulfonamide Openeye Name: N-[1-(3,4-diethoxyphenyl)ethyl]-4-nitro-benzenesulfonamide CAS Name: N-[1-(3,4-diethoxyphenyl)ethyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[1-(3,4-diethoxyphenyl)ethyl]-4-nitrobenzenesulfonamide Traditional Name: N-[1-(3,4-diethoxyphenyl)ethyl]-4-nitro-benzenesulfonamide Formula: C18H22N2O6S MolecularWeight: 394.44208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])OCC

InChI

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