N,N-diethyl-4-[3-(4-fluoranylphenoxy)propoxy]-3-nitro-benzenesulfonamide

Systemtic Name: N,N-diethyl-4-[3-(4-fluoranylphenoxy)propoxy]-3-nitro-benzenesulfonamide Openeye Name: N,N-diethyl-4-[3-(4-fluorophenoxy)propoxy]-3-nitro-benzenesulfonamide CAS Name: N,N-diethyl-4-[3-(4-fluorophenoxy)propoxy]-3-nitrobenzenesulfonamide IUPAC Name: N,N-diethyl-4-[3-(4-fluorophenoxy)propoxy]-3-nitrobenzenesulfonamide Traditional Name: N,N-diethyl-4-[3-(4-fluorophenoxy)propoxy]-3-nitro-benzenesulfonamide Formula: C19H23FN2O6S MolecularWeight: 426.459123

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OCCCOC2=CC=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OCCCOC2=CC=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C19H23FN2O6S/c1-3-21(4-2)29(25,26)17-10-11-19(18(14-17)22(23)24)28-13-5-12-27-16-8-6-15(20)7-9-16/h6-11,14H,3-5,12-13H2,1-2H3