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

Systemtic Name: [(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl-(2-methyl-1-oxidanyl-propan-2-yl)azanium Openeye Name: [(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methyl-(2-hydroxy-1,1-dimethyl-ethyl)ammonium CAS Name: [(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methyl-(1-hydroxy-2-methylpropan-2-yl)ammonium IUPAC Name: [(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl-(1-hydroxy-2-methylpropan-2-yl)azanium Traditional Name: [(2S)-5-ethoxy-2-methyl-coumaran-6-yl]methyl-(2-hydroxy-1,1-dimethyl-ethyl)ammonium Formula: C16H26NO3+ MolecularWeight: 280.38254

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25NO3/c1-5-19-14-7-12-6-11(2)20-15(12)8-13(14)9-17-16(3,4)10-18/h7-8,11,17-18H,5-6,9-10H2,1-4H3/p+1/t11-/m0/s1