(E)-1-diazonio-3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]sulfanyl-prop-1-en-2-olate

Systemtic Name: (E)-1-diazonio-3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]sulfanyl-prop-1-en-2-olate Openeye Name: (E)-1-diazonio-3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]sulfanyl-prop-1-en-2-olate CAS Name: (E)-1-diazonio-3-[[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]thio]-1-propen-2-olate IUPAC Name: (E)-1-diazonio-3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]sulfanylprop-1-en-2-olate Traditional Name: (E)-1-diazonio-3-[[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]thio]prop-1-en-2-olate Formula: C18H28N2OS MolecularWeight: 320.49272

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CCCC(=CCSCC(=C[N+]#N)[O-])C)C)C

Isomeric SMILES

CC(=CCC/C(=C/CC/C(=C/CSC/C(=C\[N+]#N)/[O-])/C)/C)C

InChI

InChI=1S/C18H28N2OS/c1-15(2)7-5-8-16(3)9-6-10-17(4)11-12-22-14-18(21)13-20-19/h7,9,11,13H,5-6,8,10,12,14H2,1-4H3/b16-9+,17-11+,18-13+