7-[2-ethyl-4-[(4-fluorophenyl)methoxy]-5-oxidanyl-phenoxy]-2,2-dimethyl-heptanenitrile

Systemtic Name: 7-[2-ethyl-4-[(4-fluorophenyl)methoxy]-5-oxidanyl-phenoxy]-2,2-dimethyl-heptanenitrile Openeye Name: 7-[2-ethyl-4-[(4-fluorophenyl)methoxy]-5-hydroxy-phenoxy]-2,2-dimethyl-heptanenitrile CAS Name: 7-[2-ethyl-4-[(4-fluorophenyl)methoxy]-5-hydroxyphenoxy]-2,2-dimethylheptanenitrile IUPAC Name: 7-[2-ethyl-4-[(4-fluorophenyl)methoxy]-5-hydroxyphenoxy]-2,2-dimethylheptanenitrile Traditional Name: 7-[2-ethyl-4-(4-fluorobenzyl)oxy-5-hydroxy-phenoxy]-2,2-dimethyl-enanthonitrile Formula: C24H30FNO3 MolecularWeight: 399.498303

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1OCCCCCC(C)(C)C#N)O)OCC2=CC=C(C=C2)F

Isomeric SMILES

CCC1=CC(=C(C=C1OCCCCCC(C)(C)C#N)O)OCC2=CC=C(C=C2)F

InChI

InChI=1S/C24H30FNO3/c1-4-19-14-23(29-16-18-8-10-20(25)11-9-18)21(27)15-22(19)28-13-7-5-6-12-24(2,3)17-26/h8-11,14-15,27H,4-7,12-13,16H2,1-3H3