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

Systemtic Name: 2-methyl-N-(3-morpholin-4-ylsulfonylphenyl)-5-nitro-benzenesulfonamide Openeye Name: 2-methyl-N-(3-morpholinosulfonylphenyl)-5-nitro-benzenesulfonamide CAS Name: 2-methyl-N-[3-(4-morpholinylsulfonyl)phenyl]-5-nitrobenzenesulfonamide IUPAC Name: 2-methyl-N-(3-morpholin-4-ylsulfonylphenyl)-5-nitrobenzenesulfonamide Traditional Name: 2-methyl-N-(3-morpholinosulfonylphenyl)-5-nitro-benzenesulfonamide Formula: C17H19N3O7S2 MolecularWeight: 441.47866

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19N3O7S2/c1-13-5-6-15(20(21)22)12-17(13)28(23,24)18-14-3-2-4-16(11-14)29(25,26)19-7-9-27-10-8-19/h2-6,11-12,18H,7-10H2,1H3