7-methoxy-3-(3-oxidanylbut-1-ynyl)chromen-2-one

Systemtic Name: 7-methoxy-3-(3-oxidanylbut-1-ynyl)chromen-2-one Openeye Name: 3-(3-hydroxybut-1-ynyl)-7-methoxy-chromen-2-one CAS Name: 3-(3-hydroxybut-1-ynyl)-7-methoxy-1-benzopyran-2-one IUPAC Name: 3-(3-hydroxybut-1-ynyl)-7-methoxychromen-2-one Traditional Name: 3-(3-hydroxybut-1-ynyl)-7-methoxy-coumarin Formula: C14H12O4 MolecularWeight: 244.24268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C#CC1=CC2=C(C=C(C=C2)OC)OC1=O)O

Isomeric SMILES

CC(C#CC1=CC2=C(C=C(C=C2)OC)OC1=O)O

InChI

InChI=1S/C14H12O4/c1-9(15)3-4-11-7-10-5-6-12(17-2)8-13(10)18-14(11)16/h5-9,15H,1-2H3