3-bromanyl-5-[2-(pyridin-4-ylamino)ethoxy]benzoic acid

Systemtic Name: 3-bromanyl-5-[2-(pyridin-4-ylamino)ethoxy]benzoic acid Openeye Name: 3-bromo-5-[2-(4-pyridylamino)ethoxy]benzoic acid CAS Name: 3-bromo-5-[2-(pyridin-4-ylamino)ethoxy]benzoic acid IUPAC Name: 3-bromo-5-[2-(pyridin-4-ylamino)ethoxy]benzoic acid Traditional Name: 3-bromo-5-[2-(4-pyridylamino)ethoxy]benzoic acid Formula: C14H13BrN2O3 MolecularWeight: 337.16862

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1NCCOC2=CC(=CC(=C2)C(=O)O)Br

Isomeric SMILES

C1=CN=CC=C1NCCOC2=CC(=CC(=C2)C(=O)O)Br

InChI

InChI=1S/C14H13BrN2O3/c15-11-7-10(14(18)19)8-13(9-11)20-6-5-17-12-1-3-16-4-2-12/h1-4,7-9H,5-6H2,(H,16,17)(H,18,19)