N-butyl-N-[2-[2-(2,3-dimethylphenyl)-5-ethyl-3-oxidanylidene-1H-pyrazol-4-yl]-2-oxidanylidene-ethyl]octanamide

Systemtic Name: N-butyl-N-[2-[2-(2,3-dimethylphenyl)-5-ethyl-3-oxidanylidene-1H-pyrazol-4-yl]-2-oxidanylidene-ethyl]octanamide Openeye Name: N-butyl-N-[2-[2-(2,3-dimethylphenyl)-5-ethyl-3-oxo-1H-pyrazol-4-yl]-2-oxo-ethyl]octanamide CAS Name: N-butyl-N-[2-[2-(2,3-dimethylphenyl)-5-ethyl-3-oxo-1H-pyrazol-4-yl]-2-oxoethyl]octanamide IUPAC Name: N-butyl-N-[2-[2-(2,3-dimethylphenyl)-5-ethyl-3-oxo-1H-pyrazol-4-yl]-2-oxoethyl]octanamide Traditional Name: N-butyl-N-[2-[1-(2,3-dimethylphenyl)-3-ethyl-5-keto-3-pyrazolin-4-yl]-2-keto-ethyl]caprylamide Formula: C27H41N3O3 MolecularWeight: 455.63274

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)N(CCCC)CC(=O)C1=C(NN(C1=O)C2=CC=CC(=C2C)C)CC

Isomeric SMILES

CCCCCCCC(=O)N(CCCC)CC(=O)C1=C(NN(C1=O)C2=CC=CC(=C2C)C)CC

InChI

InChI=1S/C27H41N3O3/c1-6-9-11-12-13-17-25(32)29(18-10-7-2)19-24(31)26-22(8-3)28-30(27(26)33)23-16-14-15-20(4)21(23)5/h14-16,28H,6-13,17-19H2,1-5H3