3-[4-(2-methylpentan-2-yl)phenoxy]-7-oxidanyl-chromen-4-one

Systemtic Name: 3-[4-(2-methylpentan-2-yl)phenoxy]-7-oxidanyl-chromen-4-one Openeye Name: 3-[4-(1,1-dimethylbutyl)phenoxy]-7-hydroxy-chromen-4-one CAS Name: 7-hydroxy-3-[4-(2-methylpentan-2-yl)phenoxy]-1-benzopyran-4-one IUPAC Name: 7-hydroxy-3-[4-(2-methylpentan-2-yl)phenoxy]chromen-4-one Traditional Name: 3-[4-(1,1-dimethylbutyl)phenoxy]-7-hydroxy-chromone Formula: C21H22O4 MolecularWeight: 338.39698

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C)C1=CC=C(C=C1)OC2=COC3=C(C2=O)C=CC(=C3)O

Isomeric SMILES

CCCC(C)(C)C1=CC=C(C=C1)OC2=COC3=C(C2=O)C=CC(=C3)O

InChI

InChI=1S/C21H22O4/c1-4-11-21(2,3)14-5-8-16(9-6-14)25-19-13-24-18-12-15(22)7-10-17(18)20(19)23/h5-10,12-13,22H,4,11H2,1-3H3