4-methyl-3-nitro-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzenesulfonamide

Systemtic Name: 4-methyl-3-nitro-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzenesulfonamide Openeye Name: 4-methyl-3-nitro-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzenesulfonamide CAS Name: 4-methyl-3-nitro-N-[4-(1-pyrrolidinylsulfonyl)phenyl]benzenesulfonamide IUPAC Name: 4-methyl-3-nitro-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzenesulfonamide Traditional Name: 4-methyl-3-nitro-N-(4-pyrrolidinosulfonylphenyl)benzenesulfonamide Formula: C17H19N3O6S2 MolecularWeight: 425.47926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O6S2/c1-13-4-7-16(12-17(13)20(21)22)27(23,24)18-14-5-8-15(9-6-14)28(25,26)19-10-2-3-11-19/h4-9,12,18H,2-3,10-11H2,1H3