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

Systemtic Name: 2-[3,4-bis(oxidanyl)phenyl]-3-(4-hydroxyphenyl)-2-methyl-pentanenitrile Openeye Name: 2-(3,4-dihydroxyphenyl)-3-(4-hydroxyphenyl)-2-methyl-pentanenitrile CAS Name: 2-(3,4-dihydroxyphenyl)-3-(4-hydroxyphenyl)-2-methylpentanenitrile IUPAC Name: 2-(3,4-dihydroxyphenyl)-3-(4-hydroxyphenyl)-2-methylpentanenitrile Traditional Name: 2-(3,4-dihydroxyphenyl)-3-(4-hydroxyphenyl)-2-methyl-valeronitrile Formula: C18H19NO3 MolecularWeight: 297.34836

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19NO3/c1-3-15(12-4-7-14(20)8-5-12)18(2,11-19)13-6-9-16(21)17(22)10-13/h4-10,15,20-22H,3H2,1-2H3