4-butyl-8-methyl-7-(3-oxidanylidenebutan-2-yloxy)chromen-2-one

Systemtic Name: 4-butyl-8-methyl-7-(3-oxidanylidenebutan-2-yloxy)chromen-2-one Openeye Name: 4-butyl-8-methyl-7-(1-methyl-2-oxo-propoxy)chromen-2-one CAS Name: 4-butyl-8-methyl-7-(3-oxobutan-2-yloxy)-1-benzopyran-2-one IUPAC Name: 4-butyl-8-methyl-7-(3-oxobutan-2-yloxy)chromen-2-one Traditional Name: 4-butyl-7-(2-keto-1-methyl-propoxy)-8-methyl-coumarin Formula: C18H22O4 MolecularWeight: 302.36488

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C1C=CC(=C2C)OC(C)C(=O)C

Isomeric SMILES

CCCCC1=CC(=O)OC2=C1C=CC(=C2C)OC(C)C(=O)C

InChI

InChI=1S/C18H22O4/c1-5-6-7-14-10-17(20)22-18-11(2)16(9-8-15(14)18)21-13(4)12(3)19/h8-10,13H,5-7H2,1-4H3