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

Systemtic Name: 2-ethylbutanoyloxymethyl 1,2,3,6-tetrahydropyridine-4-carboxylate Openeye Name: 2-ethylbutanoyloxymethyl 1,2,3,6-tetrahydropyridine-4-carboxylate CAS Name: 1,2,3,6-tetrahydropyridine-4-carboxylic acid (2-ethyl-1-oxobutoxy)methyl ester IUPAC Name: 2-ethylbutanoyloxymethyl 1,2,3,6-tetrahydropyridine-4-carboxylate Traditional Name: 1,2,3,6-tetrahydropyridine-4-carboxylic acid 2-ethylbutanoyloxymethyl ester Formula: C13H21NO4 MolecularWeight: 255.31014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21NO4/c1-3-10(4-2)12(15)17-9-18-13(16)11-5-7-14-8-6-11/h5,10,14H,3-4,6-9H2,1-2H3