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

Systemtic Name: [(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl-[2-(2-hydroxyethyloxy)ethyl]azanium Openeye Name: [(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methyl-[2-(2-hydroxyethoxy)ethyl]ammonium CAS Name: [(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methyl-[2-(2-hydroxyethoxy)ethyl]ammonium IUPAC Name: [(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl-[2-(2-hydroxyethoxy)ethyl]azanium Traditional Name: [(2S)-5-ethoxy-2-methyl-coumaran-6-yl]methyl-[2-(2-hydroxyethoxy)ethyl]ammonium Formula: C16H26NO4+ MolecularWeight: 296.38194

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25NO4/c1-3-20-15-9-13-8-12(2)21-16(13)10-14(15)11-17-4-6-19-7-5-18/h9-10,12,17-18H,3-8,11H2,1-2H3/p+1/t12-/m0/s1