2-(2,5-dimethylphenyl)-1-[4-(phenylmethyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(2,5-dimethylphenyl)-1-[4-(phenylmethyl)piperazin-1-yl]ethanone Openeye Name: 1-(4-benzylpiperazin-1-yl)-2-(2,5-dimethylphenyl)ethanone CAS Name: 2-(2,5-dimethylphenyl)-1-[4-(phenylmethyl)-1-piperazinyl]ethanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-2-(2,5-dimethylphenyl)ethanone Traditional Name: 1-(4-benzylpiperazino)-2-(2,5-dimethylphenyl)ethanone Formula: C21H26N2O MolecularWeight: 322.44394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CC(=O)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)CC(=O)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C21H26N2O/c1-17-8-9-18(2)20(14-17)15-21(24)23-12-10-22(11-13-23)16-19-6-4-3-5-7-19/h3-9,14H,10-13,15-16H2,1-2H3