methyl 2-fluoranyl-6-[3-fluoranyl-4-[(2-piperidin-1-ylethylcarbamoylamino)methyl]phenyl]benzoate

Systemtic Name: methyl 2-fluoranyl-6-[3-fluoranyl-4-[(2-piperidin-1-ylethylcarbamoylamino)methyl]phenyl]benzoate Openeye Name: methyl 2-fluoro-6-[3-fluoro-4-[[2-(1-piperidyl)ethylcarbamoylamino]methyl]phenyl]benzoate CAS Name: 2-fluoro-6-[3-fluoro-4-[[[oxo-[2-(1-piperidinyl)ethylamino]methyl]amino]methyl]phenyl]benzoic acid methyl ester IUPAC Name: methyl 2-fluoro-6-[3-fluoro-4-[(2-piperidin-1-ylethylcarbamoylamino)methyl]phenyl]benzoate Traditional Name: 2-fluoro-6-[3-fluoro-4-[(2-piperidinoethylcarbamoylamino)methyl]phenyl]benzoic acid methyl ester Formula: C23H27F2N3O3 MolecularWeight: 431.475586

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC=C1F)C2=CC(=C(C=C2)CNC(=O)NCCN3CCCCC3)F

Isomeric SMILES

COC(=O)C1=C(C=CC=C1F)C2=CC(=C(C=C2)CNC(=O)NCCN3CCCCC3)F

InChI

InChI=1S/C23H27F2N3O3/c1-31-22(29)21-18(6-5-7-19(21)24)16-8-9-17(20(25)14-16)15-27-23(30)26-10-13-28-11-3-2-4-12-28/h5-9,14H,2-4,10-13,15H2,1H3,(H2,26,27,30)