3-[3,4-bis(oxidanyl)phenyl]-2-methyl-2-phenyl-pentanenitrile

Systemtic Name: 3-[3,4-bis(oxidanyl)phenyl]-2-methyl-2-phenyl-pentanenitrile Openeye Name: 3-(3,4-dihydroxyphenyl)-2-methyl-2-phenyl-pentanenitrile CAS Name: 3-(3,4-dihydroxyphenyl)-2-methyl-2-phenylpentanenitrile IUPAC Name: 3-(3,4-dihydroxyphenyl)-2-methyl-2-phenylpentanenitrile Traditional Name: 3-(3,4-dihydroxyphenyl)-2-methyl-2-phenyl-valeronitrile Formula: C18H19NO2 MolecularWeight: 281.34896

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=C(C=C1)O)O)C(C)(C#N)C2=CC=CC=C2

Isomeric SMILES

CCC(C1=CC(=C(C=C1)O)O)C(C)(C#N)C2=CC=CC=C2

InChI

InChI=1S/C18H19NO2/c1-3-15(13-9-10-16(20)17(21)11-13)18(2,12-19)14-7-5-4-6-8-14/h4-11,15,20-21H,3H2,1-2H3