2-[(2,2-dimethyl-5-oxidanyl-4-oxidanylidene-3H-chromen-7-yl)oxy]-N-[[1-(4-methylpiperazin-1-ium-1-yl)cyclohexyl]methyl]ethanamide

Systemtic Name: 2-[(2,2-dimethyl-5-oxidanyl-4-oxidanylidene-3H-chromen-7-yl)oxy]-N-[[1-(4-methylpiperazin-1-ium-1-yl)cyclohexyl]methyl]ethanamide Openeye Name: 2-(5-hydroxy-2,2-dimethyl-4-oxo-chroman-7-yl)oxy-N-[[1-(4-methylpiperazin-1-ium-1-yl)cyclohexyl]methyl]acetamide CAS Name: 2-[(5-hydroxy-2,2-dimethyl-4-oxo-3,4-dihydro-2H-1-benzopyran-7-yl)oxy]-N-[[1-(4-methyl-1-piperazin-1-iumyl)cyclohexyl]methyl]acetamide IUPAC Name: 2-[(5-hydroxy-2,2-dimethyl-4-oxo-3H-chromen-7-yl)oxy]-N-[[1-(4-methylpiperazin-1-ium-1-yl)cyclohexyl]methyl]acetamide Traditional Name: 2-(5-hydroxy-4-keto-2,2-dimethyl-chroman-7-yl)oxy-N-[[1-(4-methylpiperazin-1-ium-1-yl)cyclohexyl]methyl]acetamide Formula: C25H38N3O5+ MolecularWeight: 460.58632

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C2=C(C=C(C=C2O1)OCC(=O)NCC3(CCCCC3)[NH+]4CCN(CC4)C)O)C

Isomeric SMILES

CC1(CC(=O)C2=C(C=C(C=C2O1)OCC(=O)NCC3(CCCCC3)[NH+]4CCN(CC4)C)O)C

InChI

InChI=1S/C25H37N3O5/c1-24(2)15-20(30)23-19(29)13-18(14-21(23)33-24)32-16-22(31)26-17-25(7-5-4-6-8-25)28-11-9-27(3)10-12-28/h13-14,29H,4-12,15-17H2,1-3H3,(H,26,31)/p+1