methyl 4-[[4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazin-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazin-1-yl]methyl]benzoate Openeye Name: methyl 4-[[4-[(2-chloro-6-fluoro-phenyl)methyl]piperazin-1-yl]methyl]benzoate CAS Name: 4-[[4-[(2-chloro-6-fluorophenyl)methyl]-1-piperazinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-[(2-chloro-6-fluorophenyl)methyl]piperazin-1-yl]methyl]benzoate Traditional Name: 4-[[4-(2-chloro-6-fluoro-benzyl)piperazino]methyl]benzoic acid methyl ester Formula: C20H22ClFN2O2 MolecularWeight: 376.852283

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CN2CCN(CC2)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CN2CCN(CC2)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C20H22ClFN2O2/c1-26-20(25)16-7-5-15(6-8-16)13-23-9-11-24(12-10-23)14-17-18(21)3-2-4-19(17)22/h2-8H,9-14H2,1H3