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

Systemtic Name: N-[5-chloranyl-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-5-methoxy-3-methyl-1-benzofuran-2-carboxamide Openeye Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-5-methoxy-3-methyl-benzofuran-2-carboxamide CAS Name: N-[5-chloro-2-(4-methyl-1-piperazin-4-iumyl)phenyl]-5-methoxy-3-methyl-2-benzofurancarboxamide IUPAC Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-5-methoxy-3-methyl-1-benzofuran-2-carboxamide Traditional Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-5-methoxy-3-methyl-coumarilamide Formula: C22H25ClN3O3+ MolecularWeight: 414.9052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)OC)C(=O)NC3=C(C=CC(=C3)Cl)N4CC[NH+](CC4)C

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)OC)C(=O)NC3=C(C=CC(=C3)Cl)N4CC[NH+](CC4)C

InChI

InChI=1S/C22H24ClN3O3/c1-14-17-13-16(28-3)5-7-20(17)29-21(14)22(27)24-18-12-15(23)4-6-19(18)26-10-8-25(2)9-11-26/h4-7,12-13H,8-11H2,1-3H3,(H,24,27)/p+1