2-(2-carbamimidoyl-3-oxidanylidene-5-phenyl-1H-pyrazol-4-yl)ethylazanium

Systemtic Name: 2-(2-carbamimidoyl-3-oxidanylidene-5-phenyl-1H-pyrazol-4-yl)ethylazanium Openeye Name: 2-(2-carbamimidoyl-3-oxo-5-phenyl-1H-pyrazol-4-yl)ethylammonium CAS Name: 2-(2-carbamimidoyl-3-oxo-5-phenyl-1H-pyrazol-4-yl)ethylammonium IUPAC Name: 2-(2-carbamimidoyl-3-oxo-5-phenyl-1H-pyrazol-4-yl)ethylazanium Traditional Name: 2-(1-amidino-5-keto-3-phenyl-3-pyrazolin-4-yl)ethylammonium Formula: C12H16N5O+ MolecularWeight: 246.28834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=O)N(N2)C(=N)N)CC[NH3+]

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=O)N(N2)C(=N)N)CC[NH3+]

InChI

InChI=1S/C12H15N5O/c13-7-6-9-10(8-4-2-1-3-5-8)16-17(11(9)18)12(14)15/h1-5,16H,6-7,13H2,(H3,14,15)/p+1