N-(2-chloranyl-4,6-dimethyl-phenyl)-2-[4-(phenylmethyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(2-chloranyl-4,6-dimethyl-phenyl)-2-[4-(phenylmethyl)piperazin-1-yl]ethanamide Openeye Name: 2-(4-benzylpiperazin-1-yl)-N-(2-chloro-4,6-dimethyl-phenyl)acetamide CAS Name: N-(2-chloro-4,6-dimethylphenyl)-2-[4-(phenylmethyl)-1-piperazinyl]acetamide IUPAC Name: 2-(4-benzylpiperazin-1-yl)-N-(2-chloro-4,6-dimethylphenyl)acetamide Traditional Name: 2-(4-benzylpiperazino)-N-(2-chloro-4,6-dimethyl-phenyl)acetamide Formula: C21H26ClN3O MolecularWeight: 371.90364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)NC(=O)CN2CCN(CC2)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)NC(=O)CN2CCN(CC2)CC3=CC=CC=C3)C

InChI

InChI=1S/C21H26ClN3O/c1-16-12-17(2)21(19(22)13-16)23-20(26)15-25-10-8-24(9-11-25)14-18-6-4-3-5-7-18/h3-7,12-13H,8-11,14-15H2,1-2H3,(H,23,26)