2-(4-bromophenyl)-2-cyclobutyl-5-(diphenethylamino)pentanenitrile

Systemtic Name: 2-(4-bromophenyl)-2-cyclobutyl-5-(diphenethylamino)pentanenitrile Openeye Name: 2-(4-bromophenyl)-2-cyclobutyl-5-(diphenethylamino)pentanenitrile CAS Name: 2-(4-bromophenyl)-2-cyclobutyl-5-(diphenethylamino)pentanenitrile IUPAC Name: 2-(4-bromophenyl)-2-cyclobutyl-5-(diphenethylamino)pentanenitrile Traditional Name: 2-(4-bromophenyl)-2-cyclobutyl-5-(diphenethylamino)valeronitrile Formula: C31H35BrN2 MolecularWeight: 515.527

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C(CCCN(CCC2=CC=CC=C2)CCC3=CC=CC=C3)(C#N)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CC(C1)C(CCCN(CCC2=CC=CC=C2)CCC3=CC=CC=C3)(C#N)C4=CC=C(C=C4)Br

InChI

InChI=1S/C31H35BrN2/c32-30-17-15-29(16-18-30)31(25-33,28-13-7-14-28)21-8-22-34(23-19-26-9-3-1-4-10-26)24-20-27-11-5-2-6-12-27/h1-6,9-12,15-18,28H,7-8,13-14,19-24H2