[(3S,4R)-3-(1,2,4-triazol-1-yl)-3,4-dihydro-2H-chromen-4-yl]azanium

Systemtic Name: [(3S,4R)-3-(1,2,4-triazol-1-yl)-3,4-dihydro-2H-chromen-4-yl]azanium Openeye Name: [(3S,4R)-3-(1,2,4-triazol-1-yl)chroman-4-yl]ammonium CAS Name: [(3S,4R)-3-(1,2,4-triazol-1-yl)-3,4-dihydro-2H-1-benzopyran-4-yl]ammonium IUPAC Name: [(3S,4R)-3-(1,2,4-triazol-1-yl)-3,4-dihydro-2H-chromen-4-yl]azanium Traditional Name: [(3S,4R)-3-(1,2,4-triazol-1-yl)chroman-4-yl]ammonium Formula: C11H13N4O+ MolecularWeight: 217.24712

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C2=CC=CC=C2O1)[NH3+])N3C=NC=N3

Isomeric SMILES

C1[C@H]([C@@H](C2=CC=CC=C2O1)[NH3+])N3C=NC=N3

InChI

InChI=1S/C11H12N4O/c12-11-8-3-1-2-4-10(8)16-5-9(11)15-7-13-6-14-15/h1-4,6-7,9,11H,5,12H2/p+1/t9-,11-/m1/s1