[(3R,4R)-6-ethoxy-2,2-dimethyl-4-oxidanyl-3,4-dihydrochromen-3-yl]azanium

Systemtic Name: [(3R,4R)-6-ethoxy-2,2-dimethyl-4-oxidanyl-3,4-dihydrochromen-3-yl]azanium Openeye Name: [(3R,4R)-6-ethoxy-4-hydroxy-2,2-dimethyl-chroman-3-yl]ammonium CAS Name: [(3R,4R)-6-ethoxy-4-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-3-yl]ammonium IUPAC Name: [(3R,4R)-6-ethoxy-4-hydroxy-2,2-dimethyl-3,4-dihydrochromen-3-yl]azanium Traditional Name: [(3R,4R)-6-ethoxy-4-hydroxy-2,2-dimethyl-chroman-3-yl]ammonium Formula: C13H20NO3+ MolecularWeight: 238.3028

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)OC(C(C2O)[NH3+])(C)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)OC([C@@H]([C@@H]2O)[NH3+])(C)C

InChI

InChI=1S/C13H19NO3/c1-4-16-8-5-6-10-9(7-8)11(15)12(14)13(2,3)17-10/h5-7,11-12,15H,4,14H2,1-3H3/p+1/t11-,12-/m1/s1