ethyl 3-nonyl-5-oxidanylidene-1,2-dihydropyrazole-4-carboxylate

Systemtic Name: ethyl 3-nonyl-5-oxidanylidene-1,2-dihydropyrazole-4-carboxylate Openeye Name: ethyl 3-nonyl-5-oxo-1,2-dihydropyrazole-4-carboxylate CAS Name: 3-nonyl-5-oxo-1,2-dihydropyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 3-nonyl-5-oxo-1,2-dihydropyrazole-4-carboxylate Traditional Name: 3-keto-5-nonyl-3-pyrazoline-4-carboxylic acid ethyl ester Formula: C15H26N2O3 MolecularWeight: 282.37854

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=C(C(=O)NN1)C(=O)OCC

Isomeric SMILES

CCCCCCCCCC1=C(C(=O)NN1)C(=O)OCC

InChI

InChI=1S/C15H26N2O3/c1-3-5-6-7-8-9-10-11-12-13(14(18)17-16-12)15(19)20-4-2/h3-11H2,1-2H3,(H2,16,17,18)