6-chloranyl-4-methyl-7-(3-oxidanylidenebutan-2-yloxy)chromen-2-one

Systemtic Name: 6-chloranyl-4-methyl-7-(3-oxidanylidenebutan-2-yloxy)chromen-2-one Openeye Name: 6-chloro-4-methyl-7-(1-methyl-2-oxo-propoxy)chromen-2-one CAS Name: 6-chloro-4-methyl-7-(3-oxobutan-2-yloxy)-1-benzopyran-2-one IUPAC Name: 6-chloro-4-methyl-7-(3-oxobutan-2-yloxy)chromen-2-one Traditional Name: 6-chloro-7-(2-keto-1-methyl-propoxy)-4-methyl-coumarin Formula: C14H13ClO4 MolecularWeight: 280.70362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC(C)C(=O)C

Isomeric SMILES

CC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC(C)C(=O)C

InChI

InChI=1S/C14H13ClO4/c1-7-4-14(17)19-12-6-13(11(15)5-10(7)12)18-9(3)8(2)16/h4-6,9H,1-3H3