N-[3-chloranyl-4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phenyl]-2,2-dimethyl-propanamide

Systemtic Name: N-[3-chloranyl-4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phenyl]-2,2-dimethyl-propanamide Openeye Name: N-[3-chloro-4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]-2,2-dimethyl-propanamide CAS Name: N-[3-chloro-4-[4-[(2-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]-2,2-dimethylpropanamide IUPAC Name: N-[3-chloro-4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]-2,2-dimethylpropanamide Traditional Name: N-[3-chloro-4-(4-o-toluoylpiperazino)phenyl]-2,2-dimethyl-propionamide Formula: C23H28ClN3O2 MolecularWeight: 413.94032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C(C)(C)C)Cl

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C(C)(C)C)Cl

InChI

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