2-(3-pyridin-4-ylpropoxycarbonyl)benzoate

Systemtic Name: 2-(3-pyridin-4-ylpropoxycarbonyl)benzoate Openeye Name: 2-[3-(4-pyridyl)propoxycarbonyl]benzoate CAS Name: 2-[oxo(3-pyridin-4-ylpropoxy)methyl]benzoate IUPAC Name: 2-(3-pyridin-4-ylpropoxycarbonyl)benzoate Traditional Name: 2-[3-(4-pyridyl)propoxycarbonyl]benzoate Formula: C16H14NO4- MolecularWeight: 284.28666

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)[O-])C(=O)OCCCC2=CC=NC=C2

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)[O-])C(=O)OCCCC2=CC=NC=C2

InChI

InChI=1S/C16H15NO4/c18-15(19)13-5-1-2-6-14(13)16(20)21-11-3-4-12-7-9-17-10-8-12/h1-2,5-10H,3-4,11H2,(H,18,19)/p-1