4-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylcarbonyl)-2-methyl-pyrazole-3-carboxylate

Systemtic Name: 4-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylcarbonyl)-2-methyl-pyrazole-3-carboxylate Openeye Name: 4-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-2-methyl-pyrazole-3-carboxylate CAS Name: 4-[1,4-dioxa-8-azaspiro[4.5]decan-8-yl(oxo)methyl]-2-methyl-3-pyrazolecarboxylate IUPAC Name: 4-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-2-methylpyrazole-3-carboxylate Traditional Name: 4-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-2-methyl-pyrazole-3-carboxylate Formula: C13H16N3O5- MolecularWeight: 294.28324

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C(=O)N2CCC3(CC2)OCCO3)C(=O)[O-]

Isomeric SMILES

CN1C(=C(C=N1)C(=O)N2CCC3(CC2)OCCO3)C(=O)[O-]

InChI

InChI=1S/C13H17N3O5/c1-15-10(12(18)19)9(8-14-15)11(17)16-4-2-13(3-5-16)20-6-7-21-13/h8H,2-7H2,1H3,(H,18,19)/p-1