2,2-dimethyl-7-pentyl-4-pyridin-2-yl-3H-chromene-4,5-diol

Systemtic Name: 2,2-dimethyl-7-pentyl-4-pyridin-2-yl-3H-chromene-4,5-diol Openeye Name: 2,2-dimethyl-7-pentyl-4-(2-pyridyl)chromane-4,5-diol CAS Name: 2,2-dimethyl-7-pentyl-4-(2-pyridinyl)-3,4-dihydro-2H-1-benzopyran-4,5-diol IUPAC Name: 2,2-dimethyl-7-pentyl-4-pyridin-2-yl-3H-chromene-4,5-diol Traditional Name: 7-amyl-2,2-dimethyl-4-(2-pyridyl)chroman-4,5-diol Formula: C21H27NO3 MolecularWeight: 341.44398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC2=C(C(=C1)O)C(CC(O2)(C)C)(C3=CC=CC=N3)O

Isomeric SMILES

CCCCCC1=CC2=C(C(=C1)O)C(CC(O2)(C)C)(C3=CC=CC=N3)O

InChI

InChI=1S/C21H27NO3/c1-4-5-6-9-15-12-16(23)19-17(13-15)25-20(2,3)14-21(19,24)18-10-7-8-11-22-18/h7-8,10-13,23-24H,4-6,9,14H2,1-3H3