2-[3,4-bis(bromanyl)phenyl]-2-cyclohexyl-5-[methyl(phenethyl)amino]pentanenitrile

Systemtic Name: 2-[3,4-bis(bromanyl)phenyl]-2-cyclohexyl-5-[methyl(phenethyl)amino]pentanenitrile Openeye Name: 2-cyclohexyl-2-(3,4-dibromophenyl)-5-[methyl(phenethyl)amino]pentanenitrile CAS Name: 2-cyclohexyl-2-(3,4-dibromophenyl)-5-[methyl(phenethyl)amino]pentanenitrile IUPAC Name: 2-cyclohexyl-2-(3,4-dibromophenyl)-5-[methyl(phenethyl)amino]pentanenitrile Traditional Name: 2-cyclohexyl-2-(3,4-dibromophenyl)-5-[methyl(phenethyl)amino]valeronitrile Formula: C26H32Br2N2 MolecularWeight: 532.35368

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(C#N)(C1CCCCC1)C2=CC(=C(C=C2)Br)Br)CCC3=CC=CC=C3

Isomeric SMILES

CN(CCCC(C#N)(C1CCCCC1)C2=CC(=C(C=C2)Br)Br)CCC3=CC=CC=C3

InChI

InChI=1S/C26H32Br2N2/c1-30(18-15-21-9-4-2-5-10-21)17-8-16-26(20-29,22-11-6-3-7-12-22)23-13-14-24(27)25(28)19-23/h2,4-5,9-10,13-14,19,22H,3,6-8,11-12,15-18H2,1H3