4-[[2-(4-fluorophenyl)quinolin-4-yl]amino]-2-[(4-methylpiperazin-1-yl)methyl]phenol

Systemtic Name: 4-[[2-(4-fluorophenyl)quinolin-4-yl]amino]-2-[(4-methylpiperazin-1-yl)methyl]phenol Openeye Name: 4-[[2-(4-fluorophenyl)-4-quinolyl]amino]-2-[(4-methylpiperazin-1-yl)methyl]phenol CAS Name: 4-[[2-(4-fluorophenyl)-4-quinolinyl]amino]-2-[(4-methyl-1-piperazinyl)methyl]phenol IUPAC Name: 4-[[2-(4-fluorophenyl)quinolin-4-yl]amino]-2-[(4-methylpiperazin-1-yl)methyl]phenol Traditional Name: 4-[[2-(4-fluorophenyl)-4-quinolyl]amino]-2-[(4-methylpiperazino)methyl]phenol Formula: C27H27FN4O MolecularWeight: 442.527883

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=C(C=CC(=C2)NC3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)F)O

Isomeric SMILES

CN1CCN(CC1)CC2=C(C=CC(=C2)NC3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)F)O

InChI

InChI=1S/C27H27FN4O/c1-31-12-14-32(15-13-31)18-20-16-22(10-11-27(20)33)29-26-17-25(19-6-8-21(28)9-7-19)30-24-5-3-2-4-23(24)26/h2-11,16-17,33H,12-15,18H2,1H3,(H,29,30)