(E,2Z)-2-(ethoxymethylidene)-6,6-dimethyl-3-oxidanyl-4-phenylsulfanyl-hept-4-enenitrile

Systemtic Name: (E,2Z)-2-(ethoxymethylidene)-6,6-dimethyl-3-oxidanyl-4-phenylsulfanyl-hept-4-enenitrile Openeye Name: (E,2Z)-2-(ethoxymethylene)-3-hydroxy-6,6-dimethyl-4-phenylsulfanyl-hept-4-enenitrile CAS Name: (E,2Z)-2-(ethoxymethylidene)-3-hydroxy-6,6-dimethyl-4-(phenylthio)-4-heptenenitrile IUPAC Name: (E,2Z)-2-(ethoxymethylidene)-3-hydroxy-6,6-dimethyl-4-phenylsulfanylhept-4-enenitrile Traditional Name: (E,2Z)-2-(ethoxymethylene)-3-hydroxy-6,6-dimethyl-4-(phenylthio)hept-4-enenitrile Formula: C18H23NO2S MolecularWeight: 317.44572

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Descriptors Computed from Structure

Canonical SMILES:

CCOC=C(C#N)C(C(=CC(C)(C)C)SC1=CC=CC=C1)O

Isomeric SMILES

CCO/C=C(/C#N)\C(/C(=C\C(C)(C)C)/SC1=CC=CC=C1)O

InChI

InChI=1S/C18H23NO2S/c1-5-21-13-14(12-19)17(20)16(11-18(2,3)4)22-15-9-7-6-8-10-15/h6-11,13,17,20H,5H2,1-4H3/b14-13-,16-11+