4-methyl-N-(4-morpholin-4-ylphenyl)-3-nitro-benzenesulfonamide

Systemtic Name: 4-methyl-N-(4-morpholin-4-ylphenyl)-3-nitro-benzenesulfonamide Openeye Name: 4-methyl-N-(4-morpholinophenyl)-3-nitro-benzenesulfonamide CAS Name: 4-methyl-N-[4-(4-morpholinyl)phenyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-methyl-N-(4-morpholin-4-ylphenyl)-3-nitrobenzenesulfonamide Traditional Name: 4-methyl-N-(4-morpholinophenyl)-3-nitro-benzenesulfonamide Formula: C17H19N3O5S MolecularWeight: 377.41486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O5S/c1-13-2-7-16(12-17(13)20(21)22)26(23,24)18-14-3-5-15(6-4-14)19-8-10-25-11-9-19/h2-7,12,18H,8-11H2,1H3