(Z)-3-dodecylsulfanyl-4-methyl-4-oxidanyl-pent-2-enenitrile

Systemtic Name: (Z)-3-dodecylsulfanyl-4-methyl-4-oxidanyl-pent-2-enenitrile Openeye Name: (Z)-3-dodecylsulfanyl-4-hydroxy-4-methyl-pent-2-enenitrile CAS Name: (Z)-3-(dodecylthio)-4-hydroxy-4-methyl-2-pentenenitrile IUPAC Name: (Z)-3-dodecylsulfanyl-4-hydroxy-4-methylpent-2-enenitrile Traditional Name: (Z)-4-hydroxy-3-(laurylthio)-4-methyl-pent-2-enenitrile Formula: C18H33NOS MolecularWeight: 311.52572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC(=CC#N)C(C)(C)O

Isomeric SMILES

CCCCCCCCCCCCS/C(=C\C#N)/C(C)(C)O

InChI

InChI=1S/C18H33NOS/c1-4-5-6-7-8-9-10-11-12-13-16-21-17(14-15-19)18(2,3)20/h14,20H,4-13,16H2,1-3H3/b17-14-