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

Systemtic Name: 4-methoxy-N-[3-methoxy-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-2-nitro-benzenesulfonamide Openeye Name: 4-methoxy-N-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]-2-nitro-benzenesulfonamide CAS Name: 4-methoxy-N-[3-methoxy-4-(2-oxo-1-pyrrolidinyl)phenyl]-2-nitrobenzenesulfonamide IUPAC Name: 4-methoxy-N-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]-2-nitrobenzenesulfonamide Traditional Name: N-[4-(2-ketopyrrolidino)-3-methoxy-phenyl]-4-methoxy-2-nitro-benzenesulfonamide Formula: C18H19N3O7S MolecularWeight: 421.42436

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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)OC)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3O7S/c1-27-13-6-8-17(15(11-13)21(23)24)29(25,26)19-12-5-7-14(16(10-12)28-2)20-9-3-4-18(20)22/h5-8,10-11,19H,3-4,9H2,1-2H3