3,6-dimethyl-N-[[1-(4-methylpiperazin-4-ium-1-yl)cyclohexyl]methyl]-1-benzofuran-2-carboxamide

Systemtic Name: 3,6-dimethyl-N-[[1-(4-methylpiperazin-4-ium-1-yl)cyclohexyl]methyl]-1-benzofuran-2-carboxamide Openeye Name: 3,6-dimethyl-N-[[1-(4-methylpiperazin-4-ium-1-yl)cyclohexyl]methyl]benzofuran-2-carboxamide CAS Name: 3,6-dimethyl-N-[[1-(4-methyl-1-piperazin-4-iumyl)cyclohexyl]methyl]-2-benzofurancarboxamide IUPAC Name: 3,6-dimethyl-N-[[1-(4-methylpiperazin-4-ium-1-yl)cyclohexyl]methyl]-1-benzofuran-2-carboxamide Traditional Name: 3,6-dimethyl-N-[[1-(4-methylpiperazin-4-ium-1-yl)cyclohexyl]methyl]coumarilamide Formula: C23H34N3O2+ MolecularWeight: 384.53496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(O2)C(=O)NCC3(CCCCC3)N4CC[NH+](CC4)C)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(O2)C(=O)NCC3(CCCCC3)N4CC[NH+](CC4)C)C

InChI

InChI=1S/C23H33N3O2/c1-17-7-8-19-18(2)21(28-20(19)15-17)22(27)24-16-23(9-5-4-6-10-23)26-13-11-25(3)12-14-26/h7-8,15H,4-6,9-14,16H2,1-3H3,(H,24,27)/p+1