2-methoxy-N-(4-morpholin-4-ylphenyl)-5-nitro-benzenesulfonamide

Systemtic Name: 2-methoxy-N-(4-morpholin-4-ylphenyl)-5-nitro-benzenesulfonamide Openeye Name: 2-methoxy-N-(4-morpholinophenyl)-5-nitro-benzenesulfonamide CAS Name: 2-methoxy-N-[4-(4-morpholinyl)phenyl]-5-nitrobenzenesulfonamide IUPAC Name: 2-methoxy-N-(4-morpholin-4-ylphenyl)-5-nitrobenzenesulfonamide Traditional Name: 2-methoxy-N-(4-morpholinophenyl)-5-nitro-benzenesulfonamide Formula: C17H19N3O6S MolecularWeight: 393.41426

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19N3O6S/c1-25-16-7-6-15(20(21)22)12-17(16)27(23,24)18-13-2-4-14(5-3-13)19-8-10-26-11-9-19/h2-7,12,18H,8-11H2,1H3