(E)-2-diazonio-2-(4-heptylcyclohexyl)sulfonyl-1-phenyl-ethenolate

Systemtic Name: (E)-2-diazonio-2-(4-heptylcyclohexyl)sulfonyl-1-phenyl-ethenolate Openeye Name: (E)-2-diazonio-2-(4-heptylcyclohexyl)sulfonyl-1-phenyl-ethenolate CAS Name: (E)-2-diazonio-2-(4-heptylcyclohexyl)sulfonyl-1-phenylethenolate IUPAC Name: (E)-2-diazonio-2-(4-heptylcyclohexyl)sulfonyl-1-phenylethenolate Traditional Name: (E)-2-diazonio-2-(4-heptylcyclohexyl)sulfonyl-1-phenyl-ethenolate Formula: C21H30N2O3S MolecularWeight: 390.5395

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)S(=O)(=O)C(=C(C2=CC=CC=C2)[O-])[N+]#N

Isomeric SMILES

CCCCCCCC1CCC(CC1)S(=O)(=O)/C(=C(\C2=CC=CC=C2)/[O-])/[N+]#N

InChI

InChI=1S/C21H30N2O3S/c1-2-3-4-5-7-10-17-13-15-19(16-14-17)27(25,26)21(23-22)20(24)18-11-8-6-9-12-18/h6,8-9,11-12,17,19H,2-5,7,10,13-16H2,1H3/b21-20+