4-nitro-N-pyren-1-yl-benzenesulfonamide

Systemtic Name: 4-nitro-N-pyren-1-yl-benzenesulfonamide Openeye Name: 4-nitro-N-pyren-1-yl-benzenesulfonamide CAS Name: 4-nitro-N-(1-pyrenyl)benzenesulfonamide IUPAC Name: 4-nitro-N-pyren-1-ylbenzenesulfonamide Traditional Name: 4-nitro-N-pyren-1-yl-benzenesulfonamide Formula: C22H14N2O4S MolecularWeight: 402.42256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)NS(=O)(=O)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)NS(=O)(=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C22H14N2O4S/c25-24(26)17-8-10-18(11-9-17)29(27,28)23-20-13-7-16-5-4-14-2-1-3-15-6-12-19(20)22(16)21(14)15/h1-13,23H