4-propoxy-2-(pyridin-4-ylmethoxy)benzoate

Systemtic Name: 4-propoxy-2-(pyridin-4-ylmethoxy)benzoate Openeye Name: 4-propoxy-2-(4-pyridylmethoxy)benzoate CAS Name: 4-propoxy-2-(pyridin-4-ylmethoxy)benzoate IUPAC Name: 4-propoxy-2-(pyridin-4-ylmethoxy)benzoate Traditional Name: 4-propoxy-2-(4-pyridylmethoxy)benzoate Formula: C16H16NO4- MolecularWeight: 286.30254

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=C(C=C1)C(=O)[O-])OCC2=CC=NC=C2

Isomeric SMILES

CCCOC1=CC(=C(C=C1)C(=O)[O-])OCC2=CC=NC=C2

InChI

InChI=1S/C16H17NO4/c1-2-9-20-13-3-4-14(16(18)19)15(10-13)21-11-12-5-7-17-8-6-12/h3-8,10H,2,9,11H2,1H3,(H,18,19)/p-1