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

Systemtic Name: 2,2-dimethyl-7-pentyl-4-pyridin-4-yl-3H-chromene-4,5-diol Openeye Name: 2,2-dimethyl-7-pentyl-4-(4-pyridyl)chromane-4,5-diol CAS Name: 2,2-dimethyl-7-pentyl-4-pyridin-4-yl-3,4-dihydro-2H-1-benzopyran-4,5-diol IUPAC Name: 2,2-dimethyl-7-pentyl-4-pyridin-4-yl-3H-chromene-4,5-diol Traditional Name: 7-amyl-2,2-dimethyl-4-(4-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=NC=C3)O

Isomeric SMILES

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

InChI

InChI=1S/C21H27NO3/c1-4-5-6-7-15-12-17(23)19-18(13-15)25-20(2,3)14-21(19,24)16-8-10-22-11-9-16/h8-13,23-24H,4-7,14H2,1-3H3