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

Systemtic Name: [(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl-prop-2-ynyl-azanium Openeye Name: [(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methyl-prop-2-ynyl-ammonium CAS Name: [(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methyl-prop-2-ynylammonium IUPAC Name: [(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl-prop-2-ynylazanium Traditional Name: [(2S)-5-ethoxy-2-methyl-coumaran-6-yl]methyl-propargyl-ammonium Formula: C15H20NO2+ MolecularWeight: 246.3248

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)C[NH2+]CC#C

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C[C@@H](O2)C)C[NH2+]CC#C

InChI

InChI=1S/C15H19NO2/c1-4-6-16-10-13-9-15-12(7-11(3)18-15)8-14(13)17-5-2/h1,8-9,11,16H,5-7,10H2,2-3H3/p+1/t11-/m0/s1