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

Systemtic Name: N-[4-(4-butanoylpiperazin-1-yl)-3-chloranyl-phenyl]-3,4-dimethyl-benzamide Openeye Name: N-[4-(4-butanoylpiperazin-1-yl)-3-chloro-phenyl]-3,4-dimethyl-benzamide CAS Name: N-[3-chloro-4-[4-(1-oxobutyl)-1-piperazinyl]phenyl]-3,4-dimethylbenzamide IUPAC Name: N-[4-(4-butanoylpiperazin-1-yl)-3-chlorophenyl]-3,4-dimethylbenzamide Traditional Name: N-[4-(4-butyrylpiperazino)-3-chloro-phenyl]-3,4-dimethyl-benzamide Formula: C23H28ClN3O2 MolecularWeight: 413.94032

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC(=C(C=C3)C)C)Cl

Isomeric SMILES

CCCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC(=C(C=C3)C)C)Cl

InChI

InChI=1S/C23H28ClN3O2/c1-4-5-22(28)27-12-10-26(11-13-27)21-9-8-19(15-20(21)24)25-23(29)18-7-6-16(2)17(3)14-18/h6-9,14-15H,4-5,10-13H2,1-3H3,(H,25,29)