(E)-2-diazonio-1-phenyl-2-(2,3,4-tributoxyphenyl)sulfonyl-ethenolate

Systemtic Name: (E)-2-diazonio-1-phenyl-2-(2,3,4-tributoxyphenyl)sulfonyl-ethenolate Openeye Name: (E)-2-diazonio-1-phenyl-2-(2,3,4-tributoxyphenyl)sulfonyl-ethenolate CAS Name: (E)-2-diazonio-1-phenyl-2-(2,3,4-tributoxyphenyl)sulfonylethenolate IUPAC Name: (E)-2-diazonio-1-phenyl-2-(2,3,4-tributoxyphenyl)sulfonylethenolate Traditional Name: (E)-2-diazonio-1-phenyl-2-(2,3,4-tributoxyphenyl)sulfonyl-ethenolate Formula: C26H34N2O6S MolecularWeight: 502.62296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C(=C(C=C1)S(=O)(=O)C(=C(C2=CC=CC=C2)[O-])[N+]#N)OCCCC)OCCCC

Isomeric SMILES

CCCCOC1=C(C(=C(C=C1)S(=O)(=O)/C(=C(\C2=CC=CC=C2)/[O-])/[N+]#N)OCCCC)OCCCC

InChI

InChI=1S/C26H34N2O6S/c1-4-7-17-32-21-15-16-22(25(34-19-9-6-3)24(21)33-18-8-5-2)35(30,31)26(28-27)23(29)20-13-11-10-12-14-20/h10-16H,4-9,17-19H2,1-3H3/b26-23+