6-chloranyl-4-methyl-7-(oxan-2-ylmethoxy)chromen-2-one

Systemtic Name: 6-chloranyl-4-methyl-7-(oxan-2-ylmethoxy)chromen-2-one Openeye Name: 6-chloro-4-methyl-7-(tetrahydropyran-2-ylmethoxy)chromen-2-one CAS Name: 6-chloro-4-methyl-7-(2-oxanylmethoxy)-1-benzopyran-2-one IUPAC Name: 6-chloro-4-methyl-7-(oxan-2-ylmethoxy)chromen-2-one Traditional Name: 6-chloro-4-methyl-7-(tetrahydropyran-2-ylmethoxy)coumarin Formula: C16H17ClO4 MolecularWeight: 308.75678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC3CCCCO3

Isomeric SMILES

CC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC3CCCCO3

InChI

InChI=1S/C16H17ClO4/c1-10-6-16(18)21-14-8-15(13(17)7-12(10)14)20-9-11-4-2-3-5-19-11/h6-8,11H,2-5,9H2,1H3