3-[4-[4-(phenylmethyl)phenyl]piperazin-1-yl]carbonylbenzoate

Systemtic Name: 3-[4-[4-(phenylmethyl)phenyl]piperazin-1-yl]carbonylbenzoate Openeye Name: 3-[4-(4-benzylphenyl)piperazine-1-carbonyl]benzoate CAS Name: 3-[oxo-[4-[4-(phenylmethyl)phenyl]-1-piperazinyl]methyl]benzoate IUPAC Name: 3-[4-(4-benzylphenyl)piperazine-1-carbonyl]benzoate Traditional Name: 3-[4-(4-benzylphenyl)piperazine-1-carbonyl]benzoate Formula: C25H23N2O3- MolecularWeight: 399.46172

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)CC3=CC=CC=C3)C(=O)C4=CC(=CC=C4)C(=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)CC3=CC=CC=C3)C(=O)C4=CC(=CC=C4)C(=O)[O-]

InChI

InChI=1S/C25H24N2O3/c28-24(21-7-4-8-22(18-21)25(29)30)27-15-13-26(14-16-27)23-11-9-20(10-12-23)17-19-5-2-1-3-6-19/h1-12,18H,13-17H2,(H,29,30)/p-1