(Z,3R)-3-acetamido-1-diazonio-4-dodecylsulfanyl-but-1-en-2-olate

Systemtic Name: (Z,3R)-3-acetamido-1-diazonio-4-dodecylsulfanyl-but-1-en-2-olate Openeye Name: (Z,3R)-3-acetamido-1-diazonio-4-dodecylsulfanyl-but-1-en-2-olate CAS Name: (Z,3R)-3-acetamido-1-diazonio-4-(dodecylthio)-1-buten-2-olate IUPAC Name: (Z,3R)-3-acetamido-1-diazonio-4-dodecylsulfanylbut-1-en-2-olate Traditional Name: (Z,3R)-3-acetamido-1-diazonio-4-(laurylthio)but-1-en-2-olate Formula: C18H33N3O2S MolecularWeight: 355.53852

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSCC(C(=C[N+]#N)[O-])NC(=O)C

Isomeric SMILES

CCCCCCCCCCCCSC[C@@H](/C(=C/[N+]#N)/[O-])NC(=O)C

InChI

InChI=1S/C18H33N3O2S/c1-3-4-5-6-7-8-9-10-11-12-13-24-15-17(21-16(2)22)18(23)14-20-19/h14,17H,3-13,15H2,1-2H3,(H-,21,22,23)/b18-14-/t17-/m0/s1