2-[[[5-(4-fluorophenyl)pyridin-3-yl]methylamino]methyl]-3,4-dihydro-2H-chromen-7-ol hydrobromide

Systemtic Name: 2-[[[5-(4-fluorophenyl)pyridin-3-yl]methylamino]methyl]-3,4-dihydro-2H-chromen-7-ol hydrobromide Openeye Name: 2-[[[5-(4-fluorophenyl)-3-pyridyl]methylamino]methyl]chroman-7-ol hydrobromide CAS Name: 2-[[[5-(4-fluorophenyl)-3-pyridinyl]methylamino]methyl]-3,4-dihydro-2H-1-benzopyran-7-ol hydrobromide IUPAC Name: 2-[[[5-(4-fluorophenyl)pyridin-3-yl]methylamino]methyl]-3,4-dihydro-2H-chromen-7-ol hydrobromide Traditional Name: 2-[[[5-(4-fluorophenyl)-3-pyridyl]methylamino]methyl]chroman-7-ol hydrobromide Formula: C22H22BrFN2O2 MolecularWeight: 445.324683

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=C(C=C2)O)OC1CNCC3=CN=CC(=C3)C4=CC=C(C=C4)F.Br

Isomeric SMILES

C1CC2=C(C=C(C=C2)O)OC1CNCC3=CN=CC(=C3)C4=CC=C(C=C4)F.Br

InChI

InChI=1S/C22H21FN2O2.BrH/c23-19-5-1-16(2-6-19)18-9-15(11-24-13-18)12-25-14-21-8-4-17-3-7-20(26)10-22(17)27-21;/h1-3,5-7,9-11,13,21,25-26H,4,8,12,14H2;1H