3-(2-methylpropoxy)propyl-[(3R)-6-oxidanyl-2,3-dihydro-1-benzofuran-3-yl]azanium

Systemtic Name: 3-(2-methylpropoxy)propyl-[(3R)-6-oxidanyl-2,3-dihydro-1-benzofuran-3-yl]azanium Openeye Name: [(3R)-6-hydroxy-2,3-dihydrobenzofuran-3-yl]-(3-isobutoxypropyl)ammonium CAS Name: [(3R)-6-hydroxy-2,3-dihydrobenzofuran-3-yl]-[3-(2-methylpropoxy)propyl]ammonium IUPAC Name: [(3R)-6-hydroxy-2,3-dihydro-1-benzofuran-3-yl]-[3-(2-methylpropoxy)propyl]azanium Traditional Name: [(3R)-6-hydroxycoumaran-3-yl]-(3-isobutoxypropyl)ammonium Formula: C15H24NO3+ MolecularWeight: 266.35596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COCCC[NH2+]C1COC2=C1C=CC(=C2)O

Isomeric SMILES

CC(C)COCCC[NH2+][C@H]1COC2=C1C=CC(=C2)O

InChI

InChI=1S/C15H23NO3/c1-11(2)9-18-7-3-6-16-14-10-19-15-8-12(17)4-5-13(14)15/h4-5,8,11,14,16-17H,3,6-7,9-10H2,1-2H3/p+1/t14-/m0/s1