2-(3-oxidanylidenebutanoyloxy)ethyl pyridine-3-carboxylate

Systemtic Name: 2-(3-oxidanylidenebutanoyloxy)ethyl pyridine-3-carboxylate Openeye Name: 2-(3-oxobutanoyloxy)ethyl pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid 2-(1,3-dioxobutoxy)ethyl ester IUPAC Name: 2-(3-oxobutanoyloxy)ethyl pyridine-3-carboxylate Traditional Name: nicotinic acid 2-acetoacetyloxyethyl ester Formula: C12H13NO5 MolecularWeight: 251.23532

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)OCCOC(=O)C1=CN=CC=C1

Isomeric SMILES

CC(=O)CC(=O)OCCOC(=O)C1=CN=CC=C1

InChI

InChI=1S/C12H13NO5/c1-9(14)7-11(15)17-5-6-18-12(16)10-3-2-4-13-8-10/h2-4,8H,5-7H2,1H3