N-[5-chloranyl-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-methyl-1-benzofuran-2-carboxamide

Systemtic Name: N-[5-chloranyl-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-methyl-1-benzofuran-2-carboxamide Openeye Name: N-[5-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-methyl-benzofuran-2-carboxamide CAS Name: N-[5-chloro-2-(4-ethyl-1-piperazin-4-iumyl)phenyl]-3-methyl-2-benzofurancarboxamide IUPAC Name: N-[5-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-methyl-1-benzofuran-2-carboxamide Traditional Name: N-[5-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-methyl-coumarilamide Formula: C22H25ClN3O2+ MolecularWeight: 398.9058

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3=C(C4=CC=CC=C4O3)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3=C(C4=CC=CC=C4O3)C

InChI

InChI=1S/C22H24ClN3O2/c1-3-25-10-12-26(13-11-25)19-9-8-16(23)14-18(19)24-22(27)21-15(2)17-6-4-5-7-20(17)28-21/h4-9,14H,3,10-13H2,1-2H3,(H,24,27)/p+1