N-[2-(4-fluorophenyl)-2-morpholin-4-yl-ethyl]-2-methyl-5-nitro-benzenesulfonamide

Systemtic Name: N-[2-(4-fluorophenyl)-2-morpholin-4-yl-ethyl]-2-methyl-5-nitro-benzenesulfonamide Openeye Name: N-[2-(4-fluorophenyl)-2-morpholino-ethyl]-2-methyl-5-nitro-benzenesulfonamide CAS Name: N-[2-(4-fluorophenyl)-2-(4-morpholinyl)ethyl]-2-methyl-5-nitrobenzenesulfonamide IUPAC Name: N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-2-methyl-5-nitrobenzenesulfonamide Traditional Name: N-[2-(4-fluorophenyl)-2-morpholino-ethyl]-2-methyl-5-nitro-benzenesulfonamide Formula: C19H22FN3O5S MolecularWeight: 423.458483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCC(C2=CC=C(C=C2)F)N3CCOCC3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCC(C2=CC=C(C=C2)F)N3CCOCC3

InChI

InChI=1S/C19H22FN3O5S/c1-14-2-7-17(23(24)25)12-19(14)29(26,27)21-13-18(22-8-10-28-11-9-22)15-3-5-16(20)6-4-15/h2-7,12,18,21H,8-11,13H2,1H3