dodecyl (Z)-3-dodecylsulfanyl-2-isocyano-prop-2-enoate

Systemtic Name: dodecyl (Z)-3-dodecylsulfanyl-2-isocyano-prop-2-enoate Openeye Name: dodecyl (Z)-3-dodecylsulfanyl-2-isocyano-prop-2-enoate CAS Name: (Z)-3-(dodecylthio)-2-isocyano-2-propenoic acid dodecyl ester IUPAC Name: dodecyl (Z)-3-dodecylsulfanyl-2-isocyanoprop-2-enoate Traditional Name: (Z)-2-isocyano-3-(laurylthio)acrylic acid lauryl ester Formula: C28H51NO2S MolecularWeight: 465.77504

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C(=CSCCCCCCCCCCCC)[N+]#[C-]

Isomeric SMILES

CCCCCCCCCCCCOC(=O)/C(=C/SCCCCCCCCCCCC)/[N+]#[C-]

InChI

InChI=1S/C28H51NO2S/c1-4-6-8-10-12-14-16-18-20-22-24-31-28(30)27(29-3)26-32-25-23-21-19-17-15-13-11-9-7-5-2/h26H,4-25H2,1-2H3/b27-26-