3-(2-pyridin-3-ylethyl)benzoic acid

Systemtic Name: 3-(2-pyridin-3-ylethyl)benzoic acid Openeye Name: 3-[2-(3-pyridyl)ethyl]benzoic acid CAS Name: 3-[2-(3-pyridinyl)ethyl]benzoic acid IUPAC Name: 3-(2-pyridin-3-ylethyl)benzoic acid Traditional Name: 3-[2-(3-pyridyl)ethyl]benzoic acid Formula: C14H13NO2 MolecularWeight: 227.25852

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CCC2=CN=CC=C2)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)CCC2=CN=CC=C2)C(=O)O

InChI

InChI=1S/C14H13NO2/c16-14(17)13-5-1-3-11(9-13)6-7-12-4-2-8-15-10-12/h1-5,8-10H,6-7H2,(H,16,17)