trimethyl 5-[(2-oxidanylidenepyrrolidin-1-yl)methyl]pyrazole-1,3,4-tricarboxylate

Systemtic Name: trimethyl 5-[(2-oxidanylidenepyrrolidin-1-yl)methyl]pyrazole-1,3,4-tricarboxylate Openeye Name: trimethyl 5-[(2-oxopyrrolidin-1-yl)methyl]pyrazole-1,3,4-tricarboxylate CAS Name: 5-[(2-oxo-1-pyrrolidinyl)methyl]pyrazole-1,3,4-tricarboxylic acid trimethyl ester IUPAC Name: trimethyl 5-[(2-oxopyrrolidin-1-yl)methyl]pyrazole-1,3,4-tricarboxylate Traditional Name: 5-[(2-ketopyrrolidino)methyl]pyrazole-1,3,4-tricarboxylic acid trimethyl ester Formula: C14H17N3O7 MolecularWeight: 339.30068

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(N=C1C(=O)OC)C(=O)OC)CN2CCCC2=O

Isomeric SMILES

COC(=O)C1=C(N(N=C1C(=O)OC)C(=O)OC)CN2CCCC2=O

InChI

InChI=1S/C14H17N3O7/c1-22-12(19)10-8(7-16-6-4-5-9(16)18)17(14(21)24-3)15-11(10)13(20)23-2/h4-7H2,1-3H3