4-[3-[4-(3-cyanophenyl)piperazin-1-yl]carbonylpyridin-2-yl]oxybenzoic acid

Systemtic Name: 4-[3-[4-(3-cyanophenyl)piperazin-1-yl]carbonylpyridin-2-yl]oxybenzoic acid Openeye Name: 4-[[3-[4-(3-cyanophenyl)piperazine-1-carbonyl]-2-pyridyl]oxy]benzoic acid CAS Name: 4-[[3-[[4-(3-cyanophenyl)-1-piperazinyl]-oxomethyl]-2-pyridinyl]oxy]benzoic acid IUPAC Name: 4-[3-[4-(3-cyanophenyl)piperazine-1-carbonyl]pyridin-2-yl]oxybenzoic acid Traditional Name: 4-[[3-[4-(3-cyanophenyl)piperazine-1-carbonyl]-2-pyridyl]oxy]benzoic acid Formula: C24H20N4O4 MolecularWeight: 428.44

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC(=C2)C#N)C(=O)C3=C(N=CC=C3)OC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1CN(CCN1C2=CC=CC(=C2)C#N)C(=O)C3=C(N=CC=C3)OC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C24H20N4O4/c25-16-17-3-1-4-19(15-17)27-11-13-28(14-12-27)23(29)21-5-2-10-26-22(21)32-20-8-6-18(7-9-20)24(30)31/h1-10,15H,11-14H2,(H,30,31)