N-[3-chloranyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-4-methoxy-2-nitro-benzenesulfonamide

Systemtic Name: N-[3-chloranyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-4-methoxy-2-nitro-benzenesulfonamide Openeye Name: N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-4-methoxy-2-nitro-benzenesulfonamide CAS Name: N-[3-chloro-4-(2-oxo-1-pyrrolidinyl)phenyl]-4-methoxy-2-nitrobenzenesulfonamide IUPAC Name: N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-4-methoxy-2-nitrobenzenesulfonamide Traditional Name: N-[3-chloro-4-(2-ketopyrrolidino)phenyl]-4-methoxy-2-nitro-benzenesulfonamide Formula: C17H16ClN3O6S MolecularWeight: 425.84344

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)N3CCCC3=O)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)N3CCCC3=O)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H16ClN3O6S/c1-27-12-5-7-16(15(10-12)21(23)24)28(25,26)19-11-4-6-14(13(18)9-11)20-8-2-3-17(20)22/h4-7,9-10,19H,2-3,8H2,1H3