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

Systemtic Name: N-[3-chloranyl-4-(4-ethanoylpiperazin-1-yl)phenyl]-3,4-dimethyl-benzamide Openeye Name: N-[4-(4-acetylpiperazin-1-yl)-3-chloro-phenyl]-3,4-dimethyl-benzamide CAS Name: N-[4-(4-acetyl-1-piperazinyl)-3-chlorophenyl]-3,4-dimethylbenzamide IUPAC Name: N-[4-(4-acetylpiperazin-1-yl)-3-chlorophenyl]-3,4-dimethylbenzamide Traditional Name: N-[4-(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=CC(=C(C=C2)N3CCN(CC3)C(=O)C)Cl)C

Isomeric SMILES

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

InChI

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