2-[4-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]phenyl]ethanoic acid

Systemtic Name: 2-[4-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]phenyl]ethanoic acid Openeye Name: 2-[4-[2-(4-benzylpiperazin-1-yl)ethyl]phenyl]acetic acid CAS Name: 2-[4-[2-[4-(phenylmethyl)-1-piperazinyl]ethyl]phenyl]acetic acid IUPAC Name: 2-[4-[2-(4-benzylpiperazin-1-yl)ethyl]phenyl]acetic acid Traditional Name: 2-[4-[2-(4-benzylpiperazino)ethyl]phenyl]acetic acid Formula: C21H26N2O2 MolecularWeight: 338.44334

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC=C(C=C2)CC(=O)O)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CCC2=CC=C(C=C2)CC(=O)O)CC3=CC=CC=C3

InChI

InChI=1S/C21H26N2O2/c24-21(25)16-19-8-6-18(7-9-19)10-11-22-12-14-23(15-13-22)17-20-4-2-1-3-5-20/h1-9H,10-17H2,(H,24,25)