4-[4-[(4-pyridin-4-ylpiperazin-1-yl)methyl]phenyl]butanoic acid

Systemtic Name: 4-[4-[(4-pyridin-4-ylpiperazin-1-yl)methyl]phenyl]butanoic acid Openeye Name: 4-[4-[[4-(4-pyridyl)piperazin-1-yl]methyl]phenyl]butanoic acid CAS Name: 4-[4-[(4-pyridin-4-yl-1-piperazinyl)methyl]phenyl]butanoic acid IUPAC Name: 4-[4-[(4-pyridin-4-ylpiperazin-1-yl)methyl]phenyl]butanoic acid Traditional Name: 4-[4-[[4-(4-pyridyl)piperazino]methyl]phenyl]butyric acid Formula: C20H25N3O2 MolecularWeight: 339.4314

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)CCCC(=O)O)C3=CC=NC=C3

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)CCCC(=O)O)C3=CC=NC=C3

InChI

InChI=1S/C20H25N3O2/c24-20(25)3-1-2-17-4-6-18(7-5-17)16-22-12-14-23(15-13-22)19-8-10-21-11-9-19/h4-11H,1-3,12-16H2,(H,24,25)