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

Systemtic Name: N-[3-chloranyl-4-[4-(phenylcarbonyl)piperazin-1-yl]phenyl]-2,4-dimethyl-benzamide Openeye Name: N-[4-(4-benzoylpiperazin-1-yl)-3-chloro-phenyl]-2,4-dimethyl-benzamide CAS Name: N-[4-(4-benzoyl-1-piperazinyl)-3-chlorophenyl]-2,4-dimethylbenzamide IUPAC Name: N-[4-(4-benzoylpiperazin-1-yl)-3-chlorophenyl]-2,4-dimethylbenzamide Traditional Name: N-[4-(4-benzoylpiperazino)-3-chloro-phenyl]-2,4-dimethyl-benzamide Formula: C26H26ClN3O2 MolecularWeight: 447.95654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4)Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4)Cl)C

InChI

InChI=1S/C26H26ClN3O2/c1-18-8-10-22(19(2)16-18)25(31)28-21-9-11-24(23(27)17-21)29-12-14-30(15-13-29)26(32)20-6-4-3-5-7-20/h3-11,16-17H,12-15H2,1-2H3,(H,28,31)