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

Systemtic Name: N-[3-chloranyl-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-1-benzofuran-2-carboxamide Openeye Name: N-[3-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]benzofuran-2-carboxamide CAS Name: N-[3-chloro-2-(4-ethyl-1-piperazin-4-iumyl)phenyl]-2-benzofurancarboxamide IUPAC Name: N-[3-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-1-benzofuran-2-carboxamide Traditional Name: N-[3-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]coumarilamide Formula: C21H23ClN3O2+ MolecularWeight: 384.87922

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=CC=C2Cl)NC(=O)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=CC=C2Cl)NC(=O)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C21H22ClN3O2/c1-2-24-10-12-25(13-11-24)20-16(22)7-5-8-17(20)23-21(26)19-14-15-6-3-4-9-18(15)27-19/h3-9,14H,2,10-13H2,1H3,(H,23,26)/p+1