2-[3-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylcarbonyl)pyrazol-1-yl]ethanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12OCCO2)C(=O)C3=NN(C=C3)CC(=O)[O-]

Isomeric SMILES

C1CN(CCC12OCCO2)C(=O)C3=NN(C=C3)CC(=O)[O-]

InChI

InChI=1S/C13H17N3O5/c17-11(18)9-16-4-1-10(14-16)12(19)15-5-2-13(3-6-15)20-7-8-21-13/h1,4H,2-3,5-9H2,(H,17,18)/p-1