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

Systemtic Name: 2-[3-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylcarbonyl)pyrazol-1-yl]ethanoic acid Openeye Name: 2-[3-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)pyrazol-1-yl]acetic acid CAS Name: 2-[3-[1,4-dioxa-8-azaspiro[4.5]decan-8-yl(oxo)methyl]-1-pyrazolyl]acetic acid IUPAC Name: 2-[3-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)pyrazol-1-yl]acetic acid Traditional Name: 2-[3-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)pyrazol-1-yl]acetic acid Formula: C13H17N3O5 MolecularWeight: 295.29118

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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)