3-fluoranyl-4-[(3-methyl-4-propan-2-yl-phenoxy)methyl]benzenecarbonitrile

Systemtic Name: 3-fluoranyl-4-[(3-methyl-4-propan-2-yl-phenoxy)methyl]benzenecarbonitrile Openeye Name: 3-fluoro-4-[(4-isopropyl-3-methyl-phenoxy)methyl]benzonitrile CAS Name: 3-fluoro-4-[(3-methyl-4-propan-2-ylphenoxy)methyl]benzonitrile IUPAC Name: 3-fluoro-4-[(3-methyl-4-propan-2-ylphenoxy)methyl]benzonitrile Traditional Name: 3-fluoro-4-[(4-isopropyl-3-methyl-phenoxy)methyl]benzonitrile Formula: C18H18FNO MolecularWeight: 283.340023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2=C(C=C(C=C2)C#N)F)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2=C(C=C(C=C2)C#N)F)C(C)C

InChI

InChI=1S/C18H18FNO/c1-12(2)17-7-6-16(8-13(17)3)21-11-15-5-4-14(10-20)9-18(15)19/h4-9,12H,11H2,1-3H3