4-(2-pyridin-4-ylpiperazin-1-yl)benzoic acid

Systemtic Name: 4-(2-pyridin-4-ylpiperazin-1-yl)benzoic acid Openeye Name: 4-[2-(4-pyridyl)piperazin-1-yl]benzoic acid CAS Name: 4-(2-pyridin-4-yl-1-piperazinyl)benzoic acid IUPAC Name: 4-(2-pyridin-4-ylpiperazin-1-yl)benzoic acid Traditional Name: 4-[2-(4-pyridyl)piperazino]benzoic acid Formula: C16H17N3O2 MolecularWeight: 283.32508

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1)C2=CC=NC=C2)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1CN(C(CN1)C2=CC=NC=C2)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C16H17N3O2/c20-16(21)13-1-3-14(4-2-13)19-10-9-18-11-15(19)12-5-7-17-8-6-12/h1-8,15,18H,9-11H2,(H,20,21)