[(3S)-6-oxidanyl-2,3-dihydro-1-benzofuran-3-yl]-(pyridin-4-ylmethyl)azanium

Systemtic Name: [(3S)-6-oxidanyl-2,3-dihydro-1-benzofuran-3-yl]-(pyridin-4-ylmethyl)azanium Openeye Name: [(3S)-6-hydroxy-2,3-dihydrobenzofuran-3-yl]-(4-pyridylmethyl)ammonium CAS Name: [(3S)-6-hydroxy-2,3-dihydrobenzofuran-3-yl]-(pyridin-4-ylmethyl)ammonium IUPAC Name: [(3S)-6-hydroxy-2,3-dihydro-1-benzofuran-3-yl]-(pyridin-4-ylmethyl)azanium Traditional Name: [(3S)-6-hydroxycoumaran-3-yl]-(4-pyridylmethyl)ammonium Formula: C14H15N2O2+ MolecularWeight: 243.2811

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=C(O1)C=C(C=C2)O)[NH2+]CC3=CC=NC=C3

Isomeric SMILES

C1[C@H](C2=C(O1)C=C(C=C2)O)[NH2+]CC3=CC=NC=C3

InChI

InChI=1S/C14H14N2O2/c17-11-1-2-12-13(9-18-14(12)7-11)16-8-10-3-5-15-6-4-10/h1-7,13,16-17H,8-9H2/p+1/t13-/m1/s1