4-[[5-ethanoyl-4-methyl-7-(3-phenylpropoxy)-1-benzofuran-6-yl]oxy]butanenitrile

Systemtic Name: 4-[[5-ethanoyl-4-methyl-7-(3-phenylpropoxy)-1-benzofuran-6-yl]oxy]butanenitrile Openeye Name: 4-[5-acetyl-4-methyl-7-(3-phenylpropoxy)benzofuran-6-yl]oxybutanenitrile CAS Name: 4-[[5-acetyl-4-methyl-7-(3-phenylpropoxy)-6-benzofuranyl]oxy]butanenitrile IUPAC Name: 4-[[5-acetyl-4-methyl-7-(3-phenylpropoxy)-1-benzofuran-6-yl]oxy]butanenitrile Traditional Name: 4-[5-acetyl-4-methyl-7-(3-phenylpropoxy)benzofuran-6-yl]oxybutyronitrile Formula: C24H25NO4 MolecularWeight: 391.4596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=COC2=C(C(=C1C(=O)C)OCCCC#N)OCCCC3=CC=CC=C3

Isomeric SMILES

CC1=C2C=COC2=C(C(=C1C(=O)C)OCCCC#N)OCCCC3=CC=CC=C3

InChI

InChI=1S/C24H25NO4/c1-17-20-12-16-29-22(20)24(28-15-8-11-19-9-4-3-5-10-19)23(21(17)18(2)26)27-14-7-6-13-25/h3-5,9-10,12,16H,6-8,11,14-15H2,1-2H3