2,2-dimethyl-7-(3-methyloctan-2-yl)-4-(1,3-thiazol-2-yl)-3H-chromene-4,5-diol

Systemtic Name: 2,2-dimethyl-7-(3-methyloctan-2-yl)-4-(1,3-thiazol-2-yl)-3H-chromene-4,5-diol Openeye Name: 7-(1,2-dimethylheptyl)-2,2-dimethyl-4-thiazol-2-yl-chromane-4,5-diol CAS Name: 2,2-dimethyl-7-(3-methyloctan-2-yl)-4-(2-thiazolyl)-3,4-dihydro-2H-1-benzopyran-4,5-diol IUPAC Name: 2,2-dimethyl-7-(3-methyloctan-2-yl)-4-(1,3-thiazol-2-yl)-3H-chromene-4,5-diol Traditional Name: 7-(1,2-dimethylheptyl)-2,2-dimethyl-4-thiazol-2-yl-chroman-4,5-diol Formula: C23H33NO3S MolecularWeight: 403.57802

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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=NC=CS3)O

Isomeric SMILES

CCCCCC(C)C(C)C1=CC2=C(C(=C1)O)C(CC(O2)(C)C)(C3=NC=CS3)O

InChI

InChI=1S/C23H33NO3S/c1-6-7-8-9-15(2)16(3)17-12-18(25)20-19(13-17)27-22(4,5)14-23(20,26)21-24-10-11-28-21/h10-13,15-16,25-26H,6-9,14H2,1-5H3