4-[azanyl(pyridin-3-yl)methyl]benzoic acid

Systemtic Name: 4-[azanyl(pyridin-3-yl)methyl]benzoic acid Openeye Name: 4-[amino(3-pyridyl)methyl]benzoic acid CAS Name: 4-[amino(3-pyridinyl)methyl]benzoic acid IUPAC Name: 4-[amino(pyridin-3-yl)methyl]benzoic acid Traditional Name: 4-[amino(3-pyridyl)methyl]benzoic acid Formula: C13H12N2O2 MolecularWeight: 228.24658

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12N2O2/c14-12(11-2-1-7-15-8-11)9-3-5-10(6-4-9)13(16)17/h1-8,12H,14H2,(H,16,17)