N,N-diethyl-4-[2-(4-fluorophenyl)morpholin-4-yl]-3-nitro-benzenesulfonamide

Systemtic Name: N,N-diethyl-4-[2-(4-fluorophenyl)morpholin-4-yl]-3-nitro-benzenesulfonamide Openeye Name: N,N-diethyl-4-[2-(4-fluorophenyl)morpholin-4-yl]-3-nitro-benzenesulfonamide CAS Name: N,N-diethyl-4-[2-(4-fluorophenyl)-4-morpholinyl]-3-nitrobenzenesulfonamide IUPAC Name: N,N-diethyl-4-[2-(4-fluorophenyl)morpholin-4-yl]-3-nitrobenzenesulfonamide Traditional Name: N,N-diethyl-4-[2-(4-fluorophenyl)morpholino]-3-nitro-benzenesulfonamide Formula: C20H24FN3O5S MolecularWeight: 437.485063

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCOC(C2)C3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCOC(C2)C3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C20H24FN3O5S/c1-3-23(4-2)30(27,28)17-9-10-18(19(13-17)24(25)26)22-11-12-29-20(14-22)15-5-7-16(21)8-6-15/h5-10,13,20H,3-4,11-12,14H2,1-2H3