2-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]carbonylbenzoic acid

Systemtic Name: 2-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]carbonylbenzoic acid Openeye Name: 2-[4-[3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]piperidine-1-carbonyl]benzoic acid CAS Name: 2-[oxo-[4-[3-(3-pyridinyl)-1,2,4-oxadiazol-5-yl]-1-piperidinyl]methyl]benzoic acid IUPAC Name: 2-[4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidine-1-carbonyl]benzoic acid Traditional Name: 2-[4-[3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]piperidine-1-carbonyl]benzoic acid Formula: C20H18N4O4 MolecularWeight: 378.38132

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC(=NO2)C3=CN=CC=C3)C(=O)C4=CC=CC=C4C(=O)O

Isomeric SMILES

C1CN(CCC1C2=NC(=NO2)C3=CN=CC=C3)C(=O)C4=CC=CC=C4C(=O)O

InChI

InChI=1S/C20H18N4O4/c25-19(15-5-1-2-6-16(15)20(26)27)24-10-7-13(8-11-24)18-22-17(23-28-18)14-4-3-9-21-12-14/h1-6,9,12-13H,7-8,10-11H2,(H,26,27)