2-[4-(3-methoxy-2-propan-2-yl-phenoxy)butoxy]benzenecarbonitrile

Systemtic Name: 2-[4-(3-methoxy-2-propan-2-yl-phenoxy)butoxy]benzenecarbonitrile Openeye Name: 2-[4-(2-isopropyl-3-methoxy-phenoxy)butoxy]benzonitrile CAS Name: 2-[4-(3-methoxy-2-propan-2-ylphenoxy)butoxy]benzonitrile IUPAC Name: 2-[4-(3-methoxy-2-propan-2-ylphenoxy)butoxy]benzonitrile Traditional Name: 2-[4-(2-isopropyl-3-methoxy-phenoxy)butoxy]benzonitrile Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CC=C1OCCCCOC2=CC=CC=C2C#N)OC

Isomeric SMILES

CC(C)C1=C(C=CC=C1OCCCCOC2=CC=CC=C2C#N)OC

InChI

InChI=1S/C21H25NO3/c1-16(2)21-19(23-3)11-8-12-20(21)25-14-7-6-13-24-18-10-5-4-9-17(18)15-22/h4-5,8-12,16H,6-7,13-14H2,1-3H3