2-[[(5E)-5-[(4-pyridin-4-ylpiperazin-1-yl)methylidene]-1H-naphthalen-2-yl]oxy]ethanoic acid

Systemtic Name: 2-[[(5E)-5-[(4-pyridin-4-ylpiperazin-1-yl)methylidene]-1H-naphthalen-2-yl]oxy]ethanoic acid Openeye Name: 2-[[(5E)-5-[[4-(4-pyridyl)piperazin-1-yl]methylene]-1H-naphthalen-2-yl]oxy]acetic acid CAS Name: 2-[[(5E)-5-[(4-pyridin-4-yl-1-piperazinyl)methylidene]-1H-naphthalen-2-yl]oxy]acetic acid IUPAC Name: 2-[[(5E)-5-[(4-pyridin-4-ylpiperazin-1-yl)methylidene]-1H-naphthalen-2-yl]oxy]acetic acid Traditional Name: 2-[[(5E)-5-[[4-(4-pyridyl)piperazino]methylene]-1H-naphthalen-2-yl]oxy]acetic acid Formula: C22H23N3O3 MolecularWeight: 377.43632

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C=C2C=CC=C3C2=CC=C(C3)OCC(=O)O)C4=CC=NC=C4

Isomeric SMILES

C1CN(CCN1/C=C/2\C=CC=C3C2=CC=C(C3)OCC(=O)O)C4=CC=NC=C4

InChI

InChI=1S/C22H23N3O3/c26-22(27)16-28-20-4-5-21-17(14-20)2-1-3-18(21)15-24-10-12-25(13-11-24)19-6-8-23-9-7-19/h1-9,15H,10-14,16H2,(H,26,27)/b18-15+