2-(5-bromanyl-6-methyl-pyridin-2-yl)-2-methoxy-3-(pyridin-3-ylmethyl)-3,4-dihydrochromen-4-ol

Systemtic Name: 2-(5-bromanyl-6-methyl-pyridin-2-yl)-2-methoxy-3-(pyridin-3-ylmethyl)-3,4-dihydrochromen-4-ol Openeye Name: 2-(5-bromo-6-methyl-2-pyridyl)-2-methoxy-3-(3-pyridylmethyl)chroman-4-ol CAS Name: 2-(5-bromo-6-methyl-2-pyridinyl)-2-methoxy-3-(3-pyridinylmethyl)-3,4-dihydro-2H-1-benzopyran-4-ol IUPAC Name: 2-(5-bromo-6-methylpyridin-2-yl)-2-methoxy-3-(pyridin-3-ylmethyl)-3,4-dihydrochromen-4-ol Traditional Name: 2-(5-bromo-6-methyl-2-pyridyl)-2-methoxy-3-(3-pyridylmethyl)chroman-4-ol Formula: C22H21BrN2O3 MolecularWeight: 441.31774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)C2(C(C(C3=CC=CC=C3O2)O)CC4=CN=CC=C4)OC)Br

Isomeric SMILES

CC1=C(C=CC(=N1)C2(C(C(C3=CC=CC=C3O2)O)CC4=CN=CC=C4)OC)Br

InChI

InChI=1S/C22H21BrN2O3/c1-14-18(23)9-10-20(25-14)22(27-2)17(12-15-6-5-11-24-13-15)21(26)16-7-3-4-8-19(16)28-22/h3-11,13,17,21,26H,12H2,1-2H3