3-methylbutanoyloxymethyl 1,2,3,6-tetrahydropyridine-4-carboxylate

Systemtic Name: 3-methylbutanoyloxymethyl 1,2,3,6-tetrahydropyridine-4-carboxylate Openeye Name: 3-methylbutanoyloxymethyl 1,2,3,6-tetrahydropyridine-4-carboxylate CAS Name: 1,2,3,6-tetrahydropyridine-4-carboxylic acid (3-methyl-1-oxobutoxy)methyl ester IUPAC Name: 3-methylbutanoyloxymethyl 1,2,3,6-tetrahydropyridine-4-carboxylate Traditional Name: 1,2,3,6-tetrahydropyridine-4-carboxylic acid isovaleryloxymethyl ester Formula: C12H19NO4 MolecularWeight: 241.28356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)OCOC(=O)C1=CCNCC1

Isomeric SMILES

CC(C)CC(=O)OCOC(=O)C1=CCNCC1

InChI

InChI=1S/C12H19NO4/c1-9(2)7-11(14)16-8-17-12(15)10-3-5-13-6-4-10/h3,9,13H,4-8H2,1-2H3