2-methyl-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-5-nitro-benzenesulfonamide

Systemtic Name: 2-methyl-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-5-nitro-benzenesulfonamide Openeye Name: 2-methyl-N-(4-methyl-3-morpholinosulfonyl-phenyl)-5-nitro-benzenesulfonamide CAS Name: 2-methyl-N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-5-nitrobenzenesulfonamide IUPAC Name: 2-methyl-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-5-nitrobenzenesulfonamide Traditional Name: 2-methyl-N-(4-methyl-3-morpholinosulfonyl-phenyl)-5-nitro-benzenesulfonamide Formula: C18H21N3O7S2 MolecularWeight: 455.50524

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O7S2/c1-13-4-6-16(21(22)23)12-17(13)29(24,25)19-15-5-3-14(2)18(11-15)30(26,27)20-7-9-28-10-8-20/h3-6,11-12,19H,7-10H2,1-2H3