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

Systemtic Name: N-[3-chloranyl-4-[4-(phenylcarbonyl)piperazin-1-yl]phenyl]-2,2-dimethyl-butanamide Openeye Name: N-[4-(4-benzoylpiperazin-1-yl)-3-chloro-phenyl]-2,2-dimethyl-butanamide CAS Name: N-[4-(4-benzoyl-1-piperazinyl)-3-chlorophenyl]-2,2-dimethylbutanamide IUPAC Name: N-[4-(4-benzoylpiperazin-1-yl)-3-chlorophenyl]-2,2-dimethylbutanamide Traditional Name: N-[4-(4-benzoylpiperazino)-3-chloro-phenyl]-2,2-dimethyl-butyramide Formula: C23H28ClN3O2 MolecularWeight: 413.94032

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3)Cl

Isomeric SMILES

CCC(C)(C)C(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3)Cl

InChI

InChI=1S/C23H28ClN3O2/c1-4-23(2,3)22(29)25-18-10-11-20(19(24)16-18)26-12-14-27(15-13-26)21(28)17-8-6-5-7-9-17/h5-11,16H,4,12-15H2,1-3H3,(H,25,29)