4-butoxy-7-methoxy-3-oxidanyl-chromen-2-one

Systemtic Name: 4-butoxy-7-methoxy-3-oxidanyl-chromen-2-one Openeye Name: 4-butoxy-3-hydroxy-7-methoxy-chromen-2-one CAS Name: 4-butoxy-3-hydroxy-7-methoxy-1-benzopyran-2-one IUPAC Name: 4-butoxy-3-hydroxy-7-methoxychromen-2-one Traditional Name: 4-butoxy-3-hydroxy-7-methoxy-coumarin Formula: C14H16O5 MolecularWeight: 264.27384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C(=O)OC2=C1C=CC(=C2)OC)O

Isomeric SMILES

CCCCOC1=C(C(=O)OC2=C1C=CC(=C2)OC)O

InChI

InChI=1S/C14H16O5/c1-3-4-7-18-13-10-6-5-9(17-2)8-11(10)19-14(16)12(13)15/h5-6,8,15H,3-4,7H2,1-2H3