3-chloranyl-5-ethoxy-4-[2-(5-methyl-2-propan-2-yl-phenoxy)ethoxy]benzenecarbonitrile

Systemtic Name: 3-chloranyl-5-ethoxy-4-[2-(5-methyl-2-propan-2-yl-phenoxy)ethoxy]benzenecarbonitrile Openeye Name: 3-chloro-5-ethoxy-4-[2-(2-isopropyl-5-methyl-phenoxy)ethoxy]benzonitrile CAS Name: 3-chloro-5-ethoxy-4-[2-(5-methyl-2-propan-2-ylphenoxy)ethoxy]benzonitrile IUPAC Name: 3-chloro-5-ethoxy-4-[2-(5-methyl-2-propan-2-ylphenoxy)ethoxy]benzonitrile Traditional Name: 3-chloro-5-ethoxy-4-[2-(2-isopropyl-5-methyl-phenoxy)ethoxy]benzonitrile Formula: C21H24ClNO3 MolecularWeight: 373.87316

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C#N)Cl)OCCOC2=C(C=CC(=C2)C)C(C)C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C#N)Cl)OCCOC2=C(C=CC(=C2)C)C(C)C

InChI

InChI=1S/C21H24ClNO3/c1-5-24-20-12-16(13-23)11-18(22)21(20)26-9-8-25-19-10-15(4)6-7-17(19)14(2)3/h6-7,10-12,14H,5,8-9H2,1-4H3