[1-phenyl-3-[4-[3-phenyl-3-(phenylcarbonyloxy)propyl]piperazin-1-yl]propyl] benzoate

Systemtic Name: [1-phenyl-3-[4-[3-phenyl-3-(phenylcarbonyloxy)propyl]piperazin-1-yl]propyl] benzoate Openeye Name: [3-[4-(3-benzoyloxy-3-phenyl-propyl)piperazin-1-yl]-1-phenyl-propyl] benzoate CAS Name: benzoic acid [3-[4-(3-benzoyloxy-3-phenylpropyl)-1-piperazinyl]-1-phenylpropyl] ester IUPAC Name: [3-[4-(3-benzoyloxy-3-phenylpropyl)piperazin-1-yl]-1-phenylpropyl] benzoate Traditional Name: benzoic acid [3-[4-(3-benzoyloxy-3-phenyl-propyl)piperazino]-1-phenyl-propyl] ester Formula: C36H38N2O4 MolecularWeight: 562.69792

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)CCC(C4=CC=CC=C4)OC(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCC(C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)CCC(C4=CC=CC=C4)OC(=O)C5=CC=CC=C5

InChI

InChI=1S/C36H38N2O4/c39-35(31-17-9-3-10-18-31)41-33(29-13-5-1-6-14-29)21-23-37-25-27-38(28-26-37)24-22-34(30-15-7-2-8-16-30)42-36(40)32-19-11-4-12-20-32/h1-20,33-34H,21-28H2