ethyl 4-[[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[4-[bis(4-fluorophenyl)methyl]piperazine-1-carbonyl]amino]benzoate CAS Name: 4-[[[4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-[bis(4-fluorophenyl)methyl]piperazine-1-carbonyl]amino]benzoate Traditional Name: 4-[[4-[bis(4-fluorophenyl)methyl]piperazine-1-carbonyl]amino]benzoic acid ethyl ester Formula: C27H27F2N3O3 MolecularWeight: 479.518386

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)N2CCN(CC2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)N2CCN(CC2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

InChI

InChI=1S/C27H27F2N3O3/c1-2-35-26(33)21-7-13-24(14-8-21)30-27(34)32-17-15-31(16-18-32)25(19-3-9-22(28)10-4-19)20-5-11-23(29)12-6-20/h3-14,25H,2,15-18H2,1H3,(H,30,34)