N-[3-(furan-2-ylmethylsulfanyl)-4-oxidanyl-naphthalen-1-yl]-4-methoxy-3-nitro-benzenesulfonamide

Systemtic Name: N-[3-(furan-2-ylmethylsulfanyl)-4-oxidanyl-naphthalen-1-yl]-4-methoxy-3-nitro-benzenesulfonamide Openeye Name: N-[3-(2-furylmethylsulfanyl)-4-hydroxy-1-naphthyl]-4-methoxy-3-nitro-benzenesulfonamide CAS Name: N-[3-(2-furanylmethylthio)-4-hydroxy-1-naphthalenyl]-4-methoxy-3-nitrobenzenesulfonamide IUPAC Name: N-[3-(furan-2-ylmethylsulfanyl)-4-hydroxynaphthalen-1-yl]-4-methoxy-3-nitrobenzenesulfonamide Traditional Name: N-[3-(2-furfurylthio)-4-hydroxy-1-naphthyl]-4-methoxy-3-nitro-benzenesulfonamide Formula: C22H18N2O7S2 MolecularWeight: 486.51752

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC(=C(C3=CC=CC=C32)O)SCC4=CC=CO4)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC(=C(C3=CC=CC=C32)O)SCC4=CC=CO4)[N+](=O)[O-]

InChI

InChI=1S/C22H18N2O7S2/c1-30-20-9-8-15(11-19(20)24(26)27)33(28,29)23-18-12-21(32-13-14-5-4-10-31-14)22(25)17-7-3-2-6-16(17)18/h2-12,23,25H,13H2,1H3