2-(4-bromophenyl)-5-(diphenethylamino)-2-propan-2-yl-heptanenitrile

Systemtic Name: 2-(4-bromophenyl)-5-(diphenethylamino)-2-propan-2-yl-heptanenitrile Openeye Name: 2-(4-bromophenyl)-5-(diphenethylamino)-2-isopropyl-heptanenitrile CAS Name: 2-(4-bromophenyl)-5-(diphenethylamino)-2-propan-2-ylheptanenitrile IUPAC Name: 2-(4-bromophenyl)-5-(diphenethylamino)-2-propan-2-ylheptanenitrile Traditional Name: 2-(4-bromophenyl)-5-(diphenethylamino)-2-isopropyl-enanthonitrile Formula: C32H39BrN2 MolecularWeight: 531.56946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC(C#N)(C1=CC=C(C=C1)Br)C(C)C)N(CCC2=CC=CC=C2)CCC3=CC=CC=C3

Isomeric SMILES

CCC(CCC(C#N)(C1=CC=C(C=C1)Br)C(C)C)N(CCC2=CC=CC=C2)CCC3=CC=CC=C3

InChI

InChI=1S/C32H39BrN2/c1-4-31(19-22-32(25-34,26(2)3)29-15-17-30(33)18-16-29)35(23-20-27-11-7-5-8-12-27)24-21-28-13-9-6-10-14-28/h5-18,26,31H,4,19-24H2,1-3H3