tert-butyl 7-pyridin-4-ylheptanoate

Systemtic Name: tert-butyl 7-pyridin-4-ylheptanoate Openeye Name: tert-butyl 7-(4-pyridyl)heptanoate CAS Name: 7-pyridin-4-ylheptanoic acid tert-butyl ester IUPAC Name: tert-butyl 7-pyridin-4-ylheptanoate Traditional Name: 7-(4-pyridyl)enanthic acid tert-butyl ester Formula: C16H25NO2 MolecularWeight: 263.3752

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCCCCCC1=CC=NC=C1

Isomeric SMILES

CC(C)(C)OC(=O)CCCCCCC1=CC=NC=C1

InChI

InChI=1S/C16H25NO2/c1-16(2,3)19-15(18)9-7-5-4-6-8-14-10-12-17-13-11-14/h10-13H,4-9H2,1-3H3