2-oxidanidyl-3-pentyl-1-phenyl-pyrazol-2-ium

Systemtic Name: 2-oxidanidyl-3-pentyl-1-phenyl-pyrazol-2-ium Openeye Name: 2-oxido-3-pentyl-1-phenyl-pyrazol-2-ium CAS Name: 2-oxido-3-pentyl-1-phenylpyrazol-2-ium IUPAC Name: 2-oxido-3-pentyl-1-phenylpyrazol-2-ium Traditional Name: 3-amyl-2-oxido-1-phenyl-pyrazol-2-ium Formula: C14H18N2O MolecularWeight: 230.30552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=[N+](N(C=C1)C2=CC=CC=C2)[O-]

Isomeric SMILES

CCCCCC1=[N+](N(C=C1)C2=CC=CC=C2)[O-]

InChI

InChI=1S/C14H18N2O/c1-2-3-5-10-14-11-12-15(16(14)17)13-8-6-4-7-9-13/h4,6-9,11-12H,2-3,5,10H2,1H3