O1-tert-butyl O4-ethyl 2-pyrazol-1-ylbutanedioate

Systemtic Name: O1-tert-butyl O4-ethyl 2-pyrazol-1-ylbutanedioate Openeye Name: O1-tert-butyl O4-ethyl 2-pyrazol-1-ylbutanedioate CAS Name: 2-(1-pyrazolyl)butanedioic acid O1-tert-butyl ester O4-ethyl ester IUPAC Name: 1-O-tert-butyl 4-O-ethyl 2-pyrazol-1-ylbutanedioate Traditional Name: 2-pyrazol-1-ylsuccinic acid O1-tert-butyl ester O4-ethyl ester Formula: C13H20N2O4 MolecularWeight: 268.3089

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C(=O)OC(C)(C)C)N1C=CC=N1

Isomeric SMILES

CCOC(=O)CC(C(=O)OC(C)(C)C)N1C=CC=N1

InChI

InChI=1S/C13H20N2O4/c1-5-18-11(16)9-10(15-8-6-7-14-15)12(17)19-13(2,3)4/h6-8,10H,5,9H2,1-4H3