(2-azanyl-2-oxidanylidene-ethyl)-[[5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl]azanium

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl)-[[5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl]azanium Openeye Name: (2-amino-2-oxo-ethyl)-[[5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl]ammonium CAS Name: (2-amino-2-oxoethyl)-[[5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl]ammonium IUPAC Name: (2-amino-2-oxoethyl)-[[5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl]azanium Traditional Name: (2-amino-2-keto-ethyl)-[[5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl]ammonium Formula: C14H19N4O+ MolecularWeight: 259.32686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C(C=NN2)C[NH2+]CC(=O)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C(C=NN2)C[NH2+]CC(=O)N)C

InChI

InChI=1S/C14H18N4O/c1-9-3-4-11(5-10(9)2)14-12(7-17-18-14)6-16-8-13(15)19/h3-5,7,16H,6,8H2,1-2H3,(H2,15,19)(H,17,18)/p+1