[2-[2-(3-chlorophenyl)-5-ethyl-3-oxidanylidene-1H-pyrazol-4-yl]-2-oxidanylidene-ethyl]-propyl-azanium

Systemtic Name: [2-[2-(3-chlorophenyl)-5-ethyl-3-oxidanylidene-1H-pyrazol-4-yl]-2-oxidanylidene-ethyl]-propyl-azanium Openeye Name: [2-[2-(3-chlorophenyl)-5-ethyl-3-oxo-1H-pyrazol-4-yl]-2-oxo-ethyl]-propyl-ammonium CAS Name: [2-[2-(3-chlorophenyl)-5-ethyl-3-oxo-1H-pyrazol-4-yl]-2-oxoethyl]-propylammonium IUPAC Name: [2-[2-(3-chlorophenyl)-5-ethyl-3-oxo-1H-pyrazol-4-yl]-2-oxoethyl]-propylazanium Traditional Name: [2-[1-(3-chlorophenyl)-3-ethyl-5-keto-3-pyrazolin-4-yl]-2-keto-ethyl]-propyl-ammonium Formula: C16H21ClN3O2+ MolecularWeight: 322.80984

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH2+]CC(=O)C1=C(NN(C1=O)C2=CC(=CC=C2)Cl)CC

Isomeric SMILES

CCC[NH2+]CC(=O)C1=C(NN(C1=O)C2=CC(=CC=C2)Cl)CC

InChI

InChI=1S/C16H20ClN3O2/c1-3-8-18-10-14(21)15-13(4-2)19-20(16(15)22)12-7-5-6-11(17)9-12/h5-7,9,18-19H,3-4,8,10H2,1-2H3/p+1