2-chloranyl-6-(3-pyridin-4-ylpropoxy)benzoate

Systemtic Name: 2-chloranyl-6-(3-pyridin-4-ylpropoxy)benzoate Openeye Name: 2-chloro-6-[3-(4-pyridyl)propoxy]benzoate CAS Name: 2-chloro-6-(3-pyridin-4-ylpropoxy)benzoate IUPAC Name: 2-chloro-6-(3-pyridin-4-ylpropoxy)benzoate Traditional Name: 2-chloro-6-[3-(4-pyridyl)propoxy]benzoate Formula: C15H13ClNO3- MolecularWeight: 290.72162

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14ClNO3/c16-12-4-1-5-13(14(12)15(18)19)20-10-2-3-11-6-8-17-9-7-11/h1,4-9H,2-3,10H2,(H,18,19)/p-1