1-[[2-fluoranyl-4-[2-[[4-(4-methylpiperazin-1-yl)piperidin-1-yl]carbonylamino]pyridin-4-yl]oxy-phenyl]carbamoyl]cyclopropane-1-carboxylic acid

Systemtic Name: 1-[[2-fluoranyl-4-[2-[[4-(4-methylpiperazin-1-yl)piperidin-1-yl]carbonylamino]pyridin-4-yl]oxy-phenyl]carbamoyl]cyclopropane-1-carboxylic acid Openeye Name: 1-[[2-fluoro-4-[[2-[[4-(4-methylpiperazin-1-yl)piperidine-1-carbonyl]amino]-4-pyridyl]oxy]phenyl]carbamoyl]cyclopropanecarboxylic acid CAS Name: 1-[[2-fluoro-4-[[2-[[[4-(4-methyl-1-piperazinyl)-1-piperidinyl]-oxomethyl]amino]-4-pyridinyl]oxy]anilino]-oxomethyl]-1-cyclopropanecarboxylic acid IUPAC Name: 1-[[2-fluoro-4-[2-[[4-(4-methylpiperazin-1-yl)piperidine-1-carbonyl]amino]pyridin-4-yl]oxyphenyl]carbamoyl]cyclopropane-1-carboxylic acid Traditional Name: 1-[[2-fluoro-4-[[2-[[4-(4-methylpiperazino)piperidine-1-carbonyl]amino]-4-pyridyl]oxy]phenyl]carbamoyl]cyclopropanecarboxylic acid Formula: C27H33FN6O5 MolecularWeight: 540.586523

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2CCN(CC2)C(=O)NC3=NC=CC(=C3)OC4=CC(=C(C=C4)NC(=O)C5(CC5)C(=O)O)F

Isomeric SMILES

CN1CCN(CC1)C2CCN(CC2)C(=O)NC3=NC=CC(=C3)OC4=CC(=C(C=C4)NC(=O)C5(CC5)C(=O)O)F

InChI

InChI=1S/C27H33FN6O5/c1-32-12-14-33(15-13-32)18-5-10-34(11-6-18)26(38)31-23-17-20(4-9-29-23)39-19-2-3-22(21(28)16-19)30-24(35)27(7-8-27)25(36)37/h2-4,9,16-18H,5-8,10-15H2,1H3,(H,30,35)(H,36,37)(H,29,31,38)