N-[3-chloranyl-4-(4-ethanoylpiperazin-1-yl)phenyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[3-chloranyl-4-(4-ethanoylpiperazin-1-yl)phenyl]-1-benzofuran-2-carboxamide Openeye Name: N-[4-(4-acetylpiperazin-1-yl)-3-chloro-phenyl]benzofuran-2-carboxamide CAS Name: N-[4-(4-acetyl-1-piperazinyl)-3-chlorophenyl]-2-benzofurancarboxamide IUPAC Name: N-[4-(4-acetylpiperazin-1-yl)-3-chlorophenyl]-1-benzofuran-2-carboxamide Traditional Name: N-[4-(4-acetylpiperazino)-3-chloro-phenyl]coumarilamide Formula: C21H20ClN3O3 MolecularWeight: 397.8548

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20ClN3O3/c1-14(26)24-8-10-25(11-9-24)18-7-6-16(13-17(18)22)23-21(27)20-12-15-4-2-3-5-19(15)28-20/h2-7,12-13H,8-11H2,1H3,(H,23,27)