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

Systemtic Name: (2-methyl-1-oxidanyl-propan-2-yl)-[(3R)-6-oxidanyl-2,3-dihydro-1-benzofuran-3-yl]azanium Openeye Name: [(3R)-6-hydroxy-2,3-dihydrobenzofuran-3-yl]-(2-hydroxy-1,1-dimethyl-ethyl)ammonium CAS Name: [(3R)-6-hydroxy-2,3-dihydrobenzofuran-3-yl]-(1-hydroxy-2-methylpropan-2-yl)ammonium IUPAC Name: [(3R)-6-hydroxy-2,3-dihydro-1-benzofuran-3-yl]-(1-hydroxy-2-methylpropan-2-yl)azanium Traditional Name: [(3R)-6-hydroxycoumaran-3-yl]-(2-hydroxy-1,1-dimethyl-ethyl)ammonium Formula: C12H18NO3+ MolecularWeight: 224.27622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO)[NH2+]C1COC2=C1C=CC(=C2)O

Isomeric SMILES

CC(C)(CO)[NH2+][C@H]1COC2=C1C=CC(=C2)O

InChI

InChI=1S/C12H17NO3/c1-12(2,7-14)13-10-6-16-11-5-8(15)3-4-9(10)11/h3-5,10,13-15H,6-7H2,1-2H3/p+1/t10-/m0/s1