2-[4-methyl-7-(2-methylprop-2-enoxy)-2-oxidanylidene-chromen-3-yl]-N-[[1-(4-methylpiperazin-1-ium-1-yl)cyclohexyl]methyl]ethanamide

Systemtic Name: 2-[4-methyl-7-(2-methylprop-2-enoxy)-2-oxidanylidene-chromen-3-yl]-N-[[1-(4-methylpiperazin-1-ium-1-yl)cyclohexyl]methyl]ethanamide Openeye Name: 2-[4-methyl-7-(2-methylallyloxy)-2-oxo-chromen-3-yl]-N-[[1-(4-methylpiperazin-1-ium-1-yl)cyclohexyl]methyl]acetamide CAS Name: 2-[4-methyl-7-(2-methylprop-2-enoxy)-2-oxo-1-benzopyran-3-yl]-N-[[1-(4-methyl-1-piperazin-1-iumyl)cyclohexyl]methyl]acetamide IUPAC Name: 2-[4-methyl-7-(2-methylprop-2-enoxy)-2-oxochromen-3-yl]-N-[[1-(4-methylpiperazin-1-ium-1-yl)cyclohexyl]methyl]acetamide Traditional Name: 2-[2-keto-4-methyl-7-(2-methylallyloxy)chromen-3-yl]-N-[[1-(4-methylpiperazin-1-ium-1-yl)cyclohexyl]methyl]acetamide Formula: C28H40N3O4+ MolecularWeight: 482.6349

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OCC(=C)C)CC(=O)NCC3(CCCCC3)[NH+]4CCN(CC4)C

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OCC(=C)C)CC(=O)NCC3(CCCCC3)[NH+]4CCN(CC4)C

InChI

InChI=1S/C28H39N3O4/c1-20(2)18-34-22-8-9-23-21(3)24(27(33)35-25(23)16-22)17-26(32)29-19-28(10-6-5-7-11-28)31-14-12-30(4)13-15-31/h8-9,16H,1,5-7,10-15,17-19H2,2-4H3,(H,29,32)/p+1