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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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