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

Systemtic Name: O1-butyl O4-ethyl 2-imidazol-1-ylbutanedioate Openeye Name: O1-butyl O4-ethyl 2-imidazol-1-ylbutanedioate CAS Name: 2-(1-imidazolyl)butanedioic acid O1-butyl ester O4-ethyl ester IUPAC Name: 1-O-butyl 4-O-ethyl 2-imidazol-1-ylbutanedioate Traditional Name: 2-imidazol-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=CN=C1

Isomeric SMILES

CCCCOC(=O)C(CC(=O)OCC)N1C=CN=C1

InChI

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