6-(3-cyano-2-oxidanylidene-chromen-8-yl)oxyhexanoic acid

Systemtic Name: 6-(3-cyano-2-oxidanylidene-chromen-8-yl)oxyhexanoic acid Openeye Name: 6-(3-cyano-2-oxo-chromen-8-yl)oxyhexanoic acid CAS Name: 6-[(3-cyano-2-oxo-1-benzopyran-8-yl)oxy]hexanoic acid IUPAC Name: 6-(3-cyano-2-oxochromen-8-yl)oxyhexanoic acid Traditional Name: 6-(3-cyano-2-keto-chromen-8-yl)oxyhexanoic acid Formula: C16H15NO5 MolecularWeight: 301.294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)OCCCCCC(=O)O)OC(=O)C(=C2)C#N

Isomeric SMILES

C1=CC2=C(C(=C1)OCCCCCC(=O)O)OC(=O)C(=C2)C#N

InChI

InChI=1S/C16H15NO5/c17-10-12-9-11-5-4-6-13(15(11)22-16(12)20)21-8-3-1-2-7-14(18)19/h4-6,9H,1-3,7-8H2,(H,18,19)