1-[1-(3-ethoxycarbonylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl]pyrazole-3-carboxylic acid

Systemtic Name: 1-[1-(3-ethoxycarbonylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl]pyrazole-3-carboxylic acid Openeye Name: 1-[2-(3-ethoxycarbonyl-1-piperidyl)-1-methyl-2-oxo-ethyl]pyrazole-3-carboxylic acid CAS Name: 1-[1-(3-ethoxycarbonyl-1-piperidinyl)-1-oxopropan-2-yl]-3-pyrazolecarboxylic acid IUPAC Name: 1-[1-(3-ethoxycarbonylpiperidin-1-yl)-1-oxopropan-2-yl]pyrazole-3-carboxylic acid Traditional Name: 1-[2-(3-carbethoxypiperidino)-2-keto-1-methyl-ethyl]pyrazole-3-carboxylic acid Formula: C15H21N3O5 MolecularWeight: 323.34434

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C(C)N2C=CC(=N2)C(=O)O

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C(C)N2C=CC(=N2)C(=O)O

InChI

InChI=1S/C15H21N3O5/c1-3-23-15(22)11-5-4-7-17(9-11)13(19)10(2)18-8-6-12(16-18)14(20)21/h6,8,10-11H,3-5,7,9H2,1-2H3,(H,20,21)