N-[2-chloranyl-5-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-2-methyl-5-nitro-benzenesulfonamide

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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