N-[2-(3,4-diethoxyphenyl)ethyl]-4-fluoranyl-3-nitro-benzenesulfonamide

Systemtic Name: N-[2-(3,4-diethoxyphenyl)ethyl]-4-fluoranyl-3-nitro-benzenesulfonamide Openeye Name: N-[2-(3,4-diethoxyphenyl)ethyl]-4-fluoro-3-nitro-benzenesulfonamide CAS Name: N-[2-(3,4-diethoxyphenyl)ethyl]-4-fluoro-3-nitrobenzenesulfonamide IUPAC Name: N-[2-(3,4-diethoxyphenyl)ethyl]-4-fluoro-3-nitrobenzenesulfonamide Traditional Name: N-[2-(3,4-diethoxyphenyl)ethyl]-4-fluoro-3-nitro-benzenesulfonamide Formula: C18H21FN2O6S MolecularWeight: 412.432543

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21FN2O6S/c1-3-26-17-8-5-13(11-18(17)27-4-2)9-10-20-28(24,25)14-6-7-15(19)16(12-14)21(22)23/h5-8,11-12,20H,3-4,9-10H2,1-2H3