3-pyridin-3-ylpropyl 3-methylbutanoate

Systemtic Name: 3-pyridin-3-ylpropyl 3-methylbutanoate Openeye Name: 3-(3-pyridyl)propyl 3-methylbutanoate CAS Name: 3-methylbutanoic acid 3-(3-pyridinyl)propyl ester IUPAC Name: 3-pyridin-3-ylpropyl 3-methylbutanoate Traditional Name: 3-methylbutyric acid 3-(3-pyridyl)propyl ester Formula: C13H19NO2 MolecularWeight: 221.29546

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)OCCCC1=CN=CC=C1

Isomeric SMILES

CC(C)CC(=O)OCCCC1=CN=CC=C1

InChI

InChI=1S/C13H19NO2/c1-11(2)9-13(15)16-8-4-6-12-5-3-7-14-10-12/h3,5,7,10-11H,4,6,8-9H2,1-2H3