3-[2-[4-(phenylmethyl)piperazin-1-yl]ethoxy]benzoic acid

Systemtic Name: 3-[2-[4-(phenylmethyl)piperazin-1-yl]ethoxy]benzoic acid Openeye Name: 3-[2-(4-benzylpiperazin-1-yl)ethoxy]benzoic acid CAS Name: 3-[2-[4-(phenylmethyl)-1-piperazinyl]ethoxy]benzoic acid IUPAC Name: 3-[2-(4-benzylpiperazin-1-yl)ethoxy]benzoic acid Traditional Name: 3-[2-(4-benzylpiperazino)ethoxy]benzoic acid Formula: C20H24N2O3 MolecularWeight: 340.41616

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCOC2=CC=CC(=C2)C(=O)O)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CCOC2=CC=CC(=C2)C(=O)O)CC3=CC=CC=C3

InChI

InChI=1S/C20H24N2O3/c23-20(24)18-7-4-8-19(15-18)25-14-13-21-9-11-22(12-10-21)16-17-5-2-1-3-6-17/h1-8,15H,9-14,16H2,(H,23,24)