2,6-bis(piperidin-1-ylmethyl)-4-[[7-(trifluoromethyl)quinolin-4-yl]amino]phenol

Systemtic Name: 2,6-bis(piperidin-1-ylmethyl)-4-[[7-(trifluoromethyl)quinolin-4-yl]amino]phenol Openeye Name: 2,6-bis(1-piperidylmethyl)-4-[[7-(trifluoromethyl)-4-quinolyl]amino]phenol CAS Name: 2,6-bis(1-piperidinylmethyl)-4-[[7-(trifluoromethyl)-4-quinolinyl]amino]phenol IUPAC Name: 2,6-bis(piperidin-1-ylmethyl)-4-[[7-(trifluoromethyl)quinolin-4-yl]amino]phenol Traditional Name: 2,6-bis(piperidinomethyl)-4-[[7-(trifluoromethyl)-4-quinolyl]amino]phenol Formula: C28H33F3N4O MolecularWeight: 498.58303

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC(=CC(=C2O)CN3CCCCC3)NC4=C5C=CC(=CC5=NC=C4)C(F)(F)F

Isomeric SMILES

C1CCN(CC1)CC2=CC(=CC(=C2O)CN3CCCCC3)NC4=C5C=CC(=CC5=NC=C4)C(F)(F)F

InChI

InChI=1S/C28H33F3N4O/c29-28(30,31)22-7-8-24-25(9-10-32-26(24)17-22)33-23-15-20(18-34-11-3-1-4-12-34)27(36)21(16-23)19-35-13-5-2-6-14-35/h7-10,15-17,36H,1-6,11-14,18-19H2,(H,32,33)