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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(CC(=O)OCC)N1C=CC=N1

Isomeric SMILES

CCCCOC(=O)C(CC(=O)OCC)N1C=CC=N1

InChI

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