ethyl (E)-3-dodecylsulfanyl-2-isocyano-prop-2-enoate

Systemtic Name: ethyl (E)-3-dodecylsulfanyl-2-isocyano-prop-2-enoate Openeye Name: ethyl (E)-3-dodecylsulfanyl-2-isocyano-prop-2-enoate CAS Name: (E)-3-(dodecylthio)-2-isocyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-dodecylsulfanyl-2-isocyanoprop-2-enoate Traditional Name: (E)-2-isocyano-3-(laurylthio)acrylic acid ethyl ester Formula: C18H31NO2S MolecularWeight: 325.50924

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC=C(C(=O)OCC)[N+]#[C-]

Isomeric SMILES

CCCCCCCCCCCCS/C=C(\C(=O)OCC)/[N+]#[C-]

InChI

InChI=1S/C18H31NO2S/c1-4-6-7-8-9-10-11-12-13-14-15-22-16-17(19-3)18(20)21-5-2/h16H,4-15H2,1-2H3/b17-16+