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

Systemtic Name: [(2S)-1-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]propan-2-yl]azanium Openeye Name: [(1S)-2-[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]-1-methyl-ethyl]ammonium CAS Name: [(2S)-1-[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]propan-2-yl]ammonium IUPAC Name: [(2S)-1-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]propan-2-yl]azanium Traditional Name: [(1S)-2-[(2S)-5-ethoxy-2-methyl-coumaran-6-yl]-1-methyl-ethyl]ammonium Formula: C14H22NO2+ MolecularWeight: 236.32998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21NO2/c1-4-16-13-7-12-6-10(3)17-14(12)8-11(13)5-9(2)15/h7-10H,4-6,15H2,1-3H3/p+1/t9-,10-/m0/s1