2-[[4-(4-propan-2-ylphenyl)carbonylpiperazin-1-yl]methyl]pentanedinitrile

Systemtic Name: 2-[[4-(4-propan-2-ylphenyl)carbonylpiperazin-1-yl]methyl]pentanedinitrile Openeye Name: 2-[[4-(4-isopropylbenzoyl)piperazin-1-yl]methyl]pentanedinitrile CAS Name: 2-[[4-[oxo-(4-propan-2-ylphenyl)methyl]-1-piperazinyl]methyl]pentanedinitrile IUPAC Name: 2-[[4-(4-propan-2-ylbenzoyl)piperazin-1-yl]methyl]pentanedinitrile Traditional Name: 2-[(4-cumoylpiperazino)methyl]glutaronitrile Formula: C20H26N4O MolecularWeight: 338.44664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)CC(CCC#N)C#N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)CC(CCC#N)C#N

InChI

InChI=1S/C20H26N4O/c1-16(2)18-5-7-19(8-6-18)20(25)24-12-10-23(11-13-24)15-17(14-22)4-3-9-21/h5-8,16-17H,3-4,10-13,15H2,1-2H3