7-[4-[3,5-bis(chloranyl)phenyl]-2-ethyl-5-oxidanyl-phenoxy]-2,2-dimethyl-heptanenitrile

Systemtic Name: 7-[4-[3,5-bis(chloranyl)phenyl]-2-ethyl-5-oxidanyl-phenoxy]-2,2-dimethyl-heptanenitrile Openeye Name: 7-[4-(3,5-dichlorophenyl)-2-ethyl-5-hydroxy-phenoxy]-2,2-dimethyl-heptanenitrile CAS Name: 7-[4-(3,5-dichlorophenyl)-2-ethyl-5-hydroxyphenoxy]-2,2-dimethylheptanenitrile IUPAC Name: 7-[4-(3,5-dichlorophenyl)-2-ethyl-5-hydroxyphenoxy]-2,2-dimethylheptanenitrile Traditional Name: 7-[4-(3,5-dichlorophenyl)-2-ethyl-5-hydroxy-phenoxy]-2,2-dimethyl-enanthonitrile Formula: C23H27Cl2NO2 MolecularWeight: 420.37198

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C(=C1)C2=CC(=CC(=C2)Cl)Cl)O)OCCCCCC(C)(C)C#N

Isomeric SMILES

CCC1=C(C=C(C(=C1)C2=CC(=CC(=C2)Cl)Cl)O)OCCCCCC(C)(C)C#N

InChI

InChI=1S/C23H27Cl2NO2/c1-4-16-12-20(17-10-18(24)13-19(25)11-17)21(27)14-22(16)28-9-7-5-6-8-23(2,3)15-26/h10-14,27H,4-9H2,1-3H3