4-[2-[4-(3-phenylpropyl)piperazin-1-yl]ethyl]benzoate

Systemtic Name: 4-[2-[4-(3-phenylpropyl)piperazin-1-yl]ethyl]benzoate Openeye Name: 4-[2-[4-(3-phenylpropyl)piperazin-1-yl]ethyl]benzoate CAS Name: 4-[2-[4-(3-phenylpropyl)-1-piperazinyl]ethyl]benzoate IUPAC Name: 4-[2-[4-(3-phenylpropyl)piperazin-1-yl]ethyl]benzoate Traditional Name: 4-[2-[4-(3-phenylpropyl)piperazino]ethyl]benzoate Formula: C22H27N2O2- MolecularWeight: 351.46198

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC2=CC=CC=C2)CCC3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

C1CN(CCN1CCCC2=CC=CC=C2)CCC3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C22H28N2O2/c25-22(26)21-10-8-20(9-11-21)12-14-24-17-15-23(16-18-24)13-4-7-19-5-2-1-3-6-19/h1-3,5-6,8-11H,4,7,12-18H2,(H,25,26)/p-1