2,2-bis(bromanyl)-3-methyl-pentanedinitrile; 2-phenoxyethanol

Systemtic Name: 2,2-bis(bromanyl)-3-methyl-pentanedinitrile; 2-phenoxyethanol Openeye Name: 2,2-dibromo-3-methyl-pentanedinitrile; 2-phenoxyethanol CAS Name: 2,2-dibromo-3-methylpentanedinitrile; 2-phenoxyethanol IUPAC Name: 2,2-dibromo-3-methylpentanedinitrile; 2-phenoxyethanol Traditional Name: 2,2-dibromo-3-methyl-glutaronitrile; 2-phenoxyethanol Formula: C14H16Br2N2O2 MolecularWeight: 404.09704

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC#N)C(C#N)(Br)Br.C1=CC=C(C=C1)OCCO

Isomeric SMILES

CC(CC#N)C(C#N)(Br)Br.C1=CC=C(C=C1)OCCO

InChI

InChI=1S/C8H10O2.C6H6Br2N2/c9-6-7-10-8-4-2-1-3-5-8;1-5(2-3-9)6(7,8)4-10/h1-5,9H,6-7H2;5H,2H2,1H3