4-(5-ethylnonan-5-yl)-3,5-dihydropyrazole-4-carboxylate

Systemtic Name: 4-(5-ethylnonan-5-yl)-3,5-dihydropyrazole-4-carboxylate Openeye Name: 4-(1-butyl-1-ethyl-pentyl)-3,5-dihydropyrazole-4-carboxylate CAS Name: 4-(5-ethylnonan-5-yl)-3,5-dihydropyrazole-4-carboxylate IUPAC Name: 4-(5-ethylnonan-5-yl)-3,5-dihydropyrazole-4-carboxylate Traditional Name: 4-(1-butyl-1-ethyl-pentyl)-1-pyrazoline-4-carboxylate Formula: C15H27N2O2- MolecularWeight: 267.38708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)(CCCC)C1(CN=NC1)C(=O)[O-]

Isomeric SMILES

CCCCC(CC)(CCCC)C1(CN=NC1)C(=O)[O-]

InChI

InChI=1S/C15H28N2O2/c1-4-7-9-14(6-3,10-8-5-2)15(13(18)19)11-16-17-12-15/h4-12H2,1-3H3,(H,18,19)/p-1