[(3R)-6-oxidanyl-2,3-dihydro-1-benzofuran-3-yl]-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)azanium

Systemtic Name: [(3R)-6-oxidanyl-2,3-dihydro-1-benzofuran-3-yl]-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)azanium Openeye Name: [(3R)-6-hydroxy-2,3-dihydrobenzofuran-3-yl]-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)ammonium CAS Name: [(3R)-6-hydroxy-2,3-dihydrobenzofuran-3-yl]-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)ammonium IUPAC Name: [(3R)-6-hydroxy-2,3-dihydro-1-benzofuran-3-yl]-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)azanium Traditional Name: [(3R)-6-hydroxycoumaran-3-yl]-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)ammonium Formula: C17H28N2O2+2 MolecularWeight: 292.41642

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC([NH2+]1)(C)C)[NH2+]C2COC3=C2C=CC(=C3)O)C

Isomeric SMILES

CC1(CC(CC([NH2+]1)(C)C)[NH2+][C@H]2COC3=C2C=CC(=C3)O)C

InChI

InChI=1S/C17H26N2O2/c1-16(2)8-11(9-17(3,4)19-16)18-14-10-21-15-7-12(20)5-6-13(14)15/h5-7,11,14,18-20H,8-10H2,1-4H3/p+2/t14-/m0/s1