N-(5-chloranyl-2-morpholin-4-yl-phenyl)-2-methoxy-5-nitro-benzenesulfonamide

Systemtic Name: N-(5-chloranyl-2-morpholin-4-yl-phenyl)-2-methoxy-5-nitro-benzenesulfonamide Openeye Name: N-(5-chloro-2-morpholino-phenyl)-2-methoxy-5-nitro-benzenesulfonamide CAS Name: N-[5-chloro-2-(4-morpholinyl)phenyl]-2-methoxy-5-nitrobenzenesulfonamide IUPAC Name: N-(5-chloro-2-morpholin-4-ylphenyl)-2-methoxy-5-nitrobenzenesulfonamide Traditional Name: N-(5-chloro-2-morpholino-phenyl)-2-methoxy-5-nitro-benzenesulfonamide Formula: C17H18ClN3O6S MolecularWeight: 427.85932

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=C(C=CC(=C2)Cl)N3CCOCC3

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=C(C=CC(=C2)Cl)N3CCOCC3

InChI

InChI=1S/C17H18ClN3O6S/c1-26-16-5-3-13(21(22)23)11-17(16)28(24,25)19-14-10-12(18)2-4-15(14)20-6-8-27-9-7-20/h2-5,10-11,19H,6-9H2,1H3