N-(5-chloranyl-2-methoxy-phenyl)-4-methyl-N-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-3-nitro-benzenesulfonamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-4-methyl-N-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-3-nitro-benzenesulfonamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-4-methyl-N-(2-morpholino-2-oxo-ethyl)-3-nitro-benzenesulfonamide CAS Name: N-(5-chloro-2-methoxyphenyl)-4-methyl-N-[2-(4-morpholinyl)-2-oxoethyl]-3-nitrobenzenesulfonamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-4-methyl-N-(2-morpholin-4-yl-2-oxoethyl)-3-nitrobenzenesulfonamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-N-(2-keto-2-morpholino-ethyl)-4-methyl-3-nitro-benzenesulfonamide Formula: C20H22ClN3O7S MolecularWeight: 483.92258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(CC(=O)N2CCOCC2)C3=C(C=CC(=C3)Cl)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(CC(=O)N2CCOCC2)C3=C(C=CC(=C3)Cl)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H22ClN3O7S/c1-14-3-5-16(12-17(14)24(26)27)32(28,29)23(13-20(25)22-7-9-31-10-8-22)18-11-15(21)4-6-19(18)30-2/h3-6,11-12H,7-10,13H2,1-2H3