[(1S,2R)-1-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]-1-oxidanyl-propan-2-yl]azanium

Systemtic Name: [(1S,2R)-1-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]-1-oxidanyl-propan-2-yl]azanium Openeye Name: [(1R,2S)-2-[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]-2-hydroxy-1-methyl-ethyl]ammonium CAS Name: [(1S,2R)-1-[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]-1-hydroxypropan-2-yl]ammonium IUPAC Name: [(1S,2R)-1-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]-1-hydroxypropan-2-yl]azanium Traditional Name: [(1R,2S)-2-[(2S)-5-ethoxy-2-methyl-coumaran-6-yl]-2-hydroxy-1-methyl-ethyl]ammonium Formula: C14H22NO3+ MolecularWeight: 252.32938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)C(C(C)[NH3+])O

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C[C@@H](O2)C)[C@@H]([C@@H](C)[NH3+])O

InChI

InChI=1S/C14H21NO3/c1-4-17-13-6-10-5-8(2)18-12(10)7-11(13)14(16)9(3)15/h6-9,14,16H,4-5,15H2,1-3H3/p+1/t8-,9+,14+/m0/s1