dimethyl-[1-[[[(3R)-6-oxidanyl-2,3-dihydro-1-benzofuran-3-yl]azaniumyl]methyl]cyclohexyl]azanium

Systemtic Name: dimethyl-[1-[[[(3R)-6-oxidanyl-2,3-dihydro-1-benzofuran-3-yl]azaniumyl]methyl]cyclohexyl]azanium Openeye Name: [1-[[[(3R)-6-hydroxy-2,3-dihydrobenzofuran-3-yl]ammonio]methyl]cyclohexyl]-dimethyl-ammonium CAS Name: [1-[[[(3R)-6-hydroxy-2,3-dihydrobenzofuran-3-yl]ammonio]methyl]cyclohexyl]-dimethylammonium IUPAC Name: [1-[[[(3R)-6-hydroxy-2,3-dihydro-1-benzofuran-3-yl]azaniumyl]methyl]cyclohexyl]-dimethylazanium Traditional Name: [1-[[[(3R)-6-hydroxycoumaran-3-yl]ammonio]methyl]cyclohexyl]-dimethyl-ammonium Formula: C17H28N2O2+2 MolecularWeight: 292.41642

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C1(CCCCC1)C[NH2+]C2COC3=C2C=CC(=C3)O

Isomeric SMILES

C[NH+](C)C1(CCCCC1)C[NH2+][C@H]2COC3=C2C=CC(=C3)O

InChI

InChI=1S/C17H26N2O2/c1-19(2)17(8-4-3-5-9-17)12-18-15-11-21-16-10-13(20)6-7-14(15)16/h6-7,10,15,18,20H,3-5,8-9,11-12H2,1-2H3/p+2/t15-/m0/s1