2,2-dimethyl-7-(3-methyloctan-2-yl)-4-pyridin-4-yl-3H-chromene-4,5-diol

Systemtic Name: 2,2-dimethyl-7-(3-methyloctan-2-yl)-4-pyridin-4-yl-3H-chromene-4,5-diol Openeye Name: 7-(1,2-dimethylheptyl)-2,2-dimethyl-4-(4-pyridyl)chromane-4,5-diol CAS Name: 2,2-dimethyl-7-(3-methyloctan-2-yl)-4-pyridin-4-yl-3,4-dihydro-2H-1-benzopyran-4,5-diol IUPAC Name: 2,2-dimethyl-7-(3-methyloctan-2-yl)-4-pyridin-4-yl-3H-chromene-4,5-diol Traditional Name: 7-(1,2-dimethylheptyl)-2,2-dimethyl-4-(4-pyridyl)chroman-4,5-diol Formula: C25H35NO3 MolecularWeight: 397.5503

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H35NO3/c1-6-7-8-9-17(2)18(3)19-14-21(27)23-22(15-19)29-24(4,5)16-25(23,28)20-10-12-26-13-11-20/h10-15,17-18,27-28H,6-9,16H2,1-5H3