3-hex-1-ynyl-4-(oxan-2-yloxy)chromen-2-one

Systemtic Name: 3-hex-1-ynyl-4-(oxan-2-yloxy)chromen-2-one Openeye Name: 3-hex-1-ynyl-4-tetrahydropyran-2-yloxy-chromen-2-one CAS Name: 3-hex-1-ynyl-4-(2-oxanyloxy)-1-benzopyran-2-one IUPAC Name: 3-hex-1-ynyl-4-(oxan-2-yloxy)chromen-2-one Traditional Name: 3-hex-1-ynyl-4-tetrahydropyran-2-yloxy-coumarin Formula: C20H22O4 MolecularWeight: 326.38628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1=C(C2=CC=CC=C2OC1=O)OC3CCCCO3

Isomeric SMILES

CCCCC#CC1=C(C2=CC=CC=C2OC1=O)OC3CCCCO3

InChI

InChI=1S/C20H22O4/c1-2-3-4-5-11-16-19(24-18-13-8-9-14-22-18)15-10-6-7-12-17(15)23-20(16)21/h6-7,10,12,18H,2-4,8-9,13-14H2,1H3