5-[(2R)-but-3-yn-2-yl]oxy-1-oxidanidyl-quinolin-1-ium

Systemtic Name: 5-[(2R)-but-3-yn-2-yl]oxy-1-oxidanidyl-quinolin-1-ium Openeye Name: 5-[(1R)-1-methylprop-2-ynoxy]-1-oxido-quinolin-1-ium CAS Name: 5-[(2R)-but-3-yn-2-yl]oxy-1-oxidoquinolin-1-ium IUPAC Name: 5-[(2R)-but-3-yn-2-yl]oxy-1-oxidoquinolin-1-ium Traditional Name: 5-[(1R)-1-methylprop-2-ynoxy]-1-oxido-quinolin-1-ium Formula: C13H11NO2 MolecularWeight: 213.23194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C#C)OC1=CC=CC2=C1C=CC=[N+]2[O-]

Isomeric SMILES

C[C@H](C#C)OC1=CC=CC2=C1C=CC=[N+]2[O-]

InChI

InChI=1S/C13H11NO2/c1-3-10(2)16-13-8-4-7-12-11(13)6-5-9-14(12)15/h1,4-10H,2H3/t10-/m1/s1