N-(2-chloranyl-5-nitro-phenyl)-3-methyl-4-(2-oxidanylidenepyrrolidin-1-yl)benzenesulfonamide

Systemtic Name: N-(2-chloranyl-5-nitro-phenyl)-3-methyl-4-(2-oxidanylidenepyrrolidin-1-yl)benzenesulfonamide Openeye Name: N-(2-chloro-5-nitro-phenyl)-3-methyl-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide CAS Name: N-(2-chloro-5-nitrophenyl)-3-methyl-4-(2-oxo-1-pyrrolidinyl)benzenesulfonamide IUPAC Name: N-(2-chloro-5-nitrophenyl)-3-methyl-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide Traditional Name: N-(2-chloro-5-nitro-phenyl)-4-(2-ketopyrrolidino)-3-methyl-benzenesulfonamide Formula: C17H16ClN3O5S MolecularWeight: 409.84404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16ClN3O5S/c1-11-9-13(5-7-16(11)20-8-2-3-17(20)22)27(25,26)19-15-10-12(21(23)24)4-6-14(15)18/h4-7,9-10,19H,2-3,8H2,1H3