(E)-2-diazonio-2-(2-hexoxy-5-methyl-phenyl)sulfonyl-1-naphthalen-2-yl-ethenolate

Systemtic Name: (E)-2-diazonio-2-(2-hexoxy-5-methyl-phenyl)sulfonyl-1-naphthalen-2-yl-ethenolate Openeye Name: (E)-2-diazonio-2-(2-hexoxy-5-methyl-phenyl)sulfonyl-1-(2-naphthyl)ethenolate CAS Name: (E)-2-diazonio-2-(2-hexoxy-5-methylphenyl)sulfonyl-1-(2-naphthalenyl)ethenolate IUPAC Name: (E)-2-diazonio-2-(2-hexoxy-5-methylphenyl)sulfonyl-1-naphthalen-2-ylethenolate Traditional Name: (E)-2-diazonio-2-(2-hexoxy-5-methyl-phenyl)sulfonyl-1-(2-naphthyl)ethenolate Formula: C25H26N2O4S MolecularWeight: 450.54994

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C)S(=O)(=O)C(=C(C2=CC3=CC=CC=C3C=C2)[O-])[N+]#N

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C)S(=O)(=O)/C(=C(\C2=CC3=CC=CC=C3C=C2)/[O-])/[N+]#N

InChI

InChI=1S/C25H26N2O4S/c1-3-4-5-8-15-31-22-14-11-18(2)16-23(22)32(29,30)25(27-26)24(28)21-13-12-19-9-6-7-10-20(19)17-21/h6-7,9-14,16-17H,3-5,8,15H2,1-2H3/b25-24+