[(1S)-1-(2-methylphenyl)ethyl]-[(3R)-6-oxidanyl-2,3-dihydro-1-benzofuran-3-yl]azanium

Systemtic Name: [(1S)-1-(2-methylphenyl)ethyl]-[(3R)-6-oxidanyl-2,3-dihydro-1-benzofuran-3-yl]azanium Openeye Name: [(3R)-6-hydroxy-2,3-dihydrobenzofuran-3-yl]-[(1S)-1-(o-tolyl)ethyl]ammonium CAS Name: [(3R)-6-hydroxy-2,3-dihydrobenzofuran-3-yl]-[(1S)-1-(2-methylphenyl)ethyl]ammonium IUPAC Name: [(3R)-6-hydroxy-2,3-dihydro-1-benzofuran-3-yl]-[(1S)-1-(2-methylphenyl)ethyl]azanium Traditional Name: [(3R)-6-hydroxycoumaran-3-yl]-[(1S)-1-(o-tolyl)ethyl]ammonium Formula: C17H20NO2+ MolecularWeight: 270.3462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C)[NH2+]C2COC3=C2C=CC(=C3)O

Isomeric SMILES

CC1=CC=CC=C1[C@H](C)[NH2+][C@H]2COC3=C2C=CC(=C3)O

InChI

InChI=1S/C17H19NO2/c1-11-5-3-4-6-14(11)12(2)18-16-10-20-17-9-13(19)7-8-15(16)17/h3-9,12,16,18-19H,10H2,1-2H3/p+1/t12-,16-/m0/s1