N-[3-chloranyl-2-(4-ethanoylpiperazin-1-yl)phenyl]-3,4-dimethyl-benzamide

Systemtic Name: N-[3-chloranyl-2-(4-ethanoylpiperazin-1-yl)phenyl]-3,4-dimethyl-benzamide Openeye Name: N-[2-(4-acetylpiperazin-1-yl)-3-chloro-phenyl]-3,4-dimethyl-benzamide CAS Name: N-[2-(4-acetyl-1-piperazinyl)-3-chlorophenyl]-3,4-dimethylbenzamide IUPAC Name: N-[2-(4-acetylpiperazin-1-yl)-3-chlorophenyl]-3,4-dimethylbenzamide Traditional Name: N-[2-(4-acetylpiperazino)-3-chloro-phenyl]-3,4-dimethyl-benzamide Formula: C21H24ClN3O2 MolecularWeight: 385.88716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=C(C(=CC=C2)Cl)N3CCN(CC3)C(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=C(C(=CC=C2)Cl)N3CCN(CC3)C(=O)C)C

InChI

InChI=1S/C21H24ClN3O2/c1-14-7-8-17(13-15(14)2)21(27)23-19-6-4-5-18(22)20(19)25-11-9-24(10-12-25)16(3)26/h4-8,13H,9-12H2,1-3H3,(H,23,27)