4-butyl-7-(3-oxidanylidenebutan-2-yloxy)chromen-2-one

Systemtic Name: 4-butyl-7-(3-oxidanylidenebutan-2-yloxy)chromen-2-one Openeye Name: 4-butyl-7-(1-methyl-2-oxo-propoxy)chromen-2-one CAS Name: 4-butyl-7-(3-oxobutan-2-yloxy)-1-benzopyran-2-one IUPAC Name: 4-butyl-7-(3-oxobutan-2-yloxy)chromen-2-one Traditional Name: 4-butyl-7-(2-keto-1-methyl-propoxy)coumarin Formula: C17H20O4 MolecularWeight: 288.3383

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C1C=CC(=C2)OC(C)C(=O)C

Isomeric SMILES

CCCCC1=CC(=O)OC2=C1C=CC(=C2)OC(C)C(=O)C

InChI

InChI=1S/C17H20O4/c1-4-5-6-13-9-17(19)21-16-10-14(7-8-15(13)16)20-12(3)11(2)18/h7-10,12H,4-6H2,1-3H3