3-[(2-azanylpyridin-3-yl)oxymethyl]-5-(3-cyanophenyl)benzoic acid

Systemtic Name: 3-[(2-azanylpyridin-3-yl)oxymethyl]-5-(3-cyanophenyl)benzoic acid Openeye Name: 3-[(2-amino-3-pyridyl)oxymethyl]-5-(3-cyanophenyl)benzoic acid CAS Name: 3-[(2-amino-3-pyridinyl)oxymethyl]-5-(3-cyanophenyl)benzoic acid IUPAC Name: 3-[(2-aminopyridin-3-yl)oxymethyl]-5-(3-cyanophenyl)benzoic acid Traditional Name: 3-[(2-amino-3-pyridyl)oxymethyl]-5-(3-cyanophenyl)benzoic acid Formula: C20H15N3O3 MolecularWeight: 345.3514

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C2=CC(=CC(=C2)COC3=C(N=CC=C3)N)C(=O)O)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C2=CC(=CC(=C2)COC3=C(N=CC=C3)N)C(=O)O)C#N

InChI

InChI=1S/C20H15N3O3/c21-11-13-3-1-4-15(7-13)16-8-14(9-17(10-16)20(24)25)12-26-18-5-2-6-23-19(18)22/h1-10H,12H2,(H2,22,23)(H,24,25)