2-[3-[(4-methoxyphenyl)methyl]-5-oxidanylidene-1,2-dihydropyrazol-4-yl]ethylazanium

Systemtic Name: 2-[3-[(4-methoxyphenyl)methyl]-5-oxidanylidene-1,2-dihydropyrazol-4-yl]ethylazanium Openeye Name: 2-[3-[(4-methoxyphenyl)methyl]-5-oxo-1,2-dihydropyrazol-4-yl]ethylammonium CAS Name: 2-[3-[(4-methoxyphenyl)methyl]-5-oxo-1,2-dihydropyrazol-4-yl]ethylammonium IUPAC Name: 2-[3-[(4-methoxyphenyl)methyl]-5-oxo-1,2-dihydropyrazol-4-yl]ethylazanium Traditional Name: 2-(3-keto-5-p-anisyl-3-pyrazolin-4-yl)ethylammonium Formula: C13H18N3O2+ MolecularWeight: 248.30092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=C(C(=O)NN2)CC[NH3+]

Isomeric SMILES

COC1=CC=C(C=C1)CC2=C(C(=O)NN2)CC[NH3+]

InChI

InChI=1S/C13H17N3O2/c1-18-10-4-2-9(3-5-10)8-12-11(6-7-14)13(17)16-15-12/h2-5H,6-8,14H2,1H3,(H2,15,16,17)/p+1