5,7-dimethoxy-8-(3-methyl-3-oxidanyl-butyl)chromen-2-one

Systemtic Name: 5,7-dimethoxy-8-(3-methyl-3-oxidanyl-butyl)chromen-2-one Openeye Name: 8-(3-hydroxy-3-methyl-butyl)-5,7-dimethoxy-chromen-2-one CAS Name: 8-(3-hydroxy-3-methylbutyl)-5,7-dimethoxy-1-benzopyran-2-one IUPAC Name: 8-(3-hydroxy-3-methylbutyl)-5,7-dimethoxychromen-2-one Traditional Name: 8-(3-hydroxy-3-methyl-butyl)-5,7-dimethoxy-coumarin Formula: C16H20O5 MolecularWeight: 292.327

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCC1=C(C=C(C2=C1OC(=O)C=C2)OC)OC)O

Isomeric SMILES

CC(C)(CCC1=C(C=C(C2=C1OC(=O)C=C2)OC)OC)O

InChI

InChI=1S/C16H20O5/c1-16(2,18)8-7-11-13(20-4)9-12(19-3)10-5-6-14(17)21-15(10)11/h5-6,9,18H,7-8H2,1-4H3