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

Systemtic Name: 5-methoxy-3-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-1-benzofuran-2-carboxamide Openeye Name: 5-methoxy-3-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]benzofuran-2-carboxamide CAS Name: 5-methoxy-3-methyl-N-[2-(4-methyl-1-piperazin-4-iumyl)phenyl]-2-benzofurancarboxamide IUPAC Name: 5-methoxy-3-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-1-benzofuran-2-carboxamide Traditional Name: 5-methoxy-3-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]coumarilamide Formula: C22H26N3O3+ MolecularWeight: 380.46014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)OC)C(=O)NC3=CC=CC=C3N4CC[NH+](CC4)C

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)OC)C(=O)NC3=CC=CC=C3N4CC[NH+](CC4)C

InChI

InChI=1S/C22H25N3O3/c1-15-17-14-16(27-3)8-9-20(17)28-21(15)22(26)23-18-6-4-5-7-19(18)25-12-10-24(2)11-13-25/h4-9,14H,10-13H2,1-3H3,(H,23,26)/p+1