[(3S)-6-oxidanyl-2,3-dihydro-1-benzofuran-3-yl]-(3-pyrrolidin-1-ium-1-ylpropyl)azanium

Systemtic Name: [(3S)-6-oxidanyl-2,3-dihydro-1-benzofuran-3-yl]-(3-pyrrolidin-1-ium-1-ylpropyl)azanium Openeye Name: [(3S)-6-hydroxy-2,3-dihydrobenzofuran-3-yl]-(3-pyrrolidin-1-ium-1-ylpropyl)ammonium CAS Name: [(3S)-6-hydroxy-2,3-dihydrobenzofuran-3-yl]-[3-(1-pyrrolidin-1-iumyl)propyl]ammonium IUPAC Name: [(3S)-6-hydroxy-2,3-dihydro-1-benzofuran-3-yl]-(3-pyrrolidin-1-ium-1-ylpropyl)azanium Traditional Name: [(3S)-6-hydroxycoumaran-3-yl]-(3-pyrrolidin-1-ium-1-ylpropyl)ammonium Formula: C15H24N2O2+2 MolecularWeight: 264.36326

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCC[NH2+]C2COC3=C2C=CC(=C3)O

Isomeric SMILES

C1CC[NH+](C1)CCC[NH2+][C@@H]2COC3=C2C=CC(=C3)O

InChI

InChI=1S/C15H22N2O2/c18-12-4-5-13-14(11-19-15(13)10-12)16-6-3-9-17-7-1-2-8-17/h4-5,10,14,16,18H,1-3,6-9,11H2/p+2/t14-/m1/s1