2-(4-butyl-6-chloranyl-2-oxidanylidene-chromen-7-yl)oxypropanoic acid

Systemtic Name: 2-(4-butyl-6-chloranyl-2-oxidanylidene-chromen-7-yl)oxypropanoic acid Openeye Name: 2-(4-butyl-6-chloro-2-oxo-chromen-7-yl)oxypropanoic acid CAS Name: 2-[(4-butyl-6-chloro-2-oxo-1-benzopyran-7-yl)oxy]propanoic acid IUPAC Name: 2-(4-butyl-6-chloro-2-oxochromen-7-yl)oxypropanoic acid Traditional Name: 2-(4-butyl-6-chloro-2-keto-chromen-7-yl)oxypropionic acid Formula: C16H17ClO5 MolecularWeight: 324.75618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC(C)C(=O)O

Isomeric SMILES

CCCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC(C)C(=O)O

InChI

InChI=1S/C16H17ClO5/c1-3-4-5-10-6-15(18)22-13-8-14(12(17)7-11(10)13)21-9(2)16(19)20/h6-9H,3-5H2,1-2H3,(H,19,20)