methyl 2-fluoranyl-6-[3-fluoranyl-4-[[[5-(4-methylpiperazin-1-yl)carbonylpyridin-2-yl]amino]methyl]phenyl]benzoate

Systemtic Name: methyl 2-fluoranyl-6-[3-fluoranyl-4-[[[5-(4-methylpiperazin-1-yl)carbonylpyridin-2-yl]amino]methyl]phenyl]benzoate Openeye Name: methyl 2-fluoro-6-[3-fluoro-4-[[[5-(4-methylpiperazine-1-carbonyl)-2-pyridyl]amino]methyl]phenyl]benzoate CAS Name: 2-fluoro-6-[3-fluoro-4-[[[5-[(4-methyl-1-piperazinyl)-oxomethyl]-2-pyridinyl]amino]methyl]phenyl]benzoic acid methyl ester IUPAC Name: methyl 2-fluoro-6-[3-fluoro-4-[[[5-(4-methylpiperazine-1-carbonyl)pyridin-2-yl]amino]methyl]phenyl]benzoate Traditional Name: 2-fluoro-6-[3-fluoro-4-[[[5-(4-methylpiperazine-1-carbonyl)-2-pyridyl]amino]methyl]phenyl]benzoic acid methyl ester Formula: C26H26F2N4O3 MolecularWeight: 480.506446

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=CN=C(C=C2)NCC3=C(C=C(C=C3)C4=C(C(=CC=C4)F)C(=O)OC)F

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=CN=C(C=C2)NCC3=C(C=C(C=C3)C4=C(C(=CC=C4)F)C(=O)OC)F

InChI

InChI=1S/C26H26F2N4O3/c1-31-10-12-32(13-11-31)25(33)19-8-9-23(30-16-19)29-15-18-7-6-17(14-22(18)28)20-4-3-5-21(27)24(20)26(34)35-2/h3-9,14,16H,10-13,15H2,1-2H3,(H,29,30)