N-[3-chloranyl-4-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]phenyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[3-chloranyl-4-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]phenyl]-1-benzofuran-2-carboxamide Openeye Name: N-[3-chloro-4-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]phenyl]benzofuran-2-carboxamide CAS Name: N-[3-chloro-4-[4-(2,2-dimethyl-1-oxopropyl)-1-piperazinyl]phenyl]-2-benzofurancarboxamide IUPAC Name: N-[3-chloro-4-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]phenyl]-1-benzofuran-2-carboxamide Traditional Name: N-[3-chloro-4-(4-pivaloylpiperazino)phenyl]coumarilamide Formula: C24H26ClN3O3 MolecularWeight: 439.93454

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC4=CC=CC=C4O3)Cl

Isomeric SMILES

CC(C)(C)C(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC4=CC=CC=C4O3)Cl

InChI

InChI=1S/C24H26ClN3O3/c1-24(2,3)23(30)28-12-10-27(11-13-28)19-9-8-17(15-18(19)25)26-22(29)21-14-16-6-4-5-7-20(16)31-21/h4-9,14-15H,10-13H2,1-3H3,(H,26,29)