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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)C=C(C4=CC=CC(=C43)C=C2)NS(=O)(=O)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C3C(=C1)C=C(C4=CC=CC(=C43)C=C2)NS(=O)(=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

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