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

Systemtic Name: 2-[[4-(4-ethylphenyl)carbonylpiperazin-1-yl]methyl]pentanedinitrile Openeye Name: 2-[[4-(4-ethylbenzoyl)piperazin-1-yl]methyl]pentanedinitrile CAS Name: 2-[[4-[(4-ethylphenyl)-oxomethyl]-1-piperazinyl]methyl]pentanedinitrile IUPAC Name: 2-[[4-(4-ethylbenzoyl)piperazin-1-yl]methyl]pentanedinitrile Traditional Name: 2-[[4-(4-ethylbenzoyl)piperazino]methyl]glutaronitrile Formula: C19H24N4O MolecularWeight: 324.42006

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)CC(CCC#N)C#N

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)CC(CCC#N)C#N

InChI

InChI=1S/C19H24N4O/c1-2-16-5-7-18(8-6-16)19(24)23-12-10-22(11-13-23)15-17(14-21)4-3-9-20/h5-8,17H,2-4,10-13,15H2,1H3