5,6-dimethoxy-8-(3-methyl-2-oxidanylidene-butyl)chromen-2-one

Systemtic Name: 5,6-dimethoxy-8-(3-methyl-2-oxidanylidene-butyl)chromen-2-one Openeye Name: 5,6-dimethoxy-8-(3-methyl-2-oxo-butyl)chromen-2-one CAS Name: 5,6-dimethoxy-8-(3-methyl-2-oxobutyl)-1-benzopyran-2-one IUPAC Name: 5,6-dimethoxy-8-(3-methyl-2-oxobutyl)chromen-2-one Traditional Name: 8-(2-keto-3-methyl-butyl)-5,6-dimethoxy-coumarin Formula: C16H18O5 MolecularWeight: 290.31112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)CC1=CC(=C(C2=C1OC(=O)C=C2)OC)OC

Isomeric SMILES

CC(C)C(=O)CC1=CC(=C(C2=C1OC(=O)C=C2)OC)OC

InChI

InChI=1S/C16H18O5/c1-9(2)12(17)7-10-8-13(19-3)16(20-4)11-5-6-14(18)21-15(10)11/h5-6,8-9H,7H2,1-4H3