dimethyl-[[2-methyl-5-oxidanyl-3-[(1S)-1-oxidanylethyl]-1-benzofuran-4-yl]methyl]azanium

Systemtic Name: dimethyl-[[2-methyl-5-oxidanyl-3-[(1S)-1-oxidanylethyl]-1-benzofuran-4-yl]methyl]azanium Openeye Name: [5-hydroxy-3-[(1S)-1-hydroxyethyl]-2-methyl-benzofuran-4-yl]methyl-dimethyl-ammonium CAS Name: [5-hydroxy-3-[(1S)-1-hydroxyethyl]-2-methyl-4-benzofuranyl]methyl-dimethylammonium IUPAC Name: [5-hydroxy-3-[(1S)-1-hydroxyethyl]-2-methyl-1-benzofuran-4-yl]methyl-dimethylazanium Traditional Name: [5-hydroxy-3-[(1S)-1-hydroxyethyl]-2-methyl-benzofuran-4-yl]methyl-dimethyl-ammonium Formula: C14H20NO3+ MolecularWeight: 250.3135

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)C=CC(=C2C[NH+](C)C)O)C(C)O

Isomeric SMILES

CC1=C(C2=C(O1)C=CC(=C2C[NH+](C)C)O)[C@H](C)O

InChI

InChI=1S/C14H19NO3/c1-8(16)13-9(2)18-12-6-5-11(17)10(14(12)13)7-15(3)4/h5-6,8,16-17H,7H2,1-4H3/p+1/t8-/m0/s1