(3-cyano-7-ethoxy-7-ethyl-4-methyl-2-oxidanylidene-8H-chromen-5-yl)phosphonic acid

Systemtic Name: (3-cyano-7-ethoxy-7-ethyl-4-methyl-2-oxidanylidene-8H-chromen-5-yl)phosphonic acid Openeye Name: (3-cyano-7-ethoxy-7-ethyl-4-methyl-2-oxo-8H-chromen-5-yl)phosphonic acid CAS Name: (3-cyano-7-ethoxy-7-ethyl-4-methyl-2-oxo-8H-1-benzopyran-5-yl)phosphonic acid IUPAC Name: (3-cyano-7-ethoxy-7-ethyl-4-methyl-2-oxo-8H-chromen-5-yl)phosphonic acid Traditional Name: (3-cyano-7-ethoxy-7-ethyl-2-keto-4-methyl-8H-chromen-5-yl)phosphonic acid Formula: C15H18NO6P MolecularWeight: 339.280281

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC2=C(C(=C(C(=O)O2)C#N)C)C(=C1)P(=O)(O)O)OCC

Isomeric SMILES

CCC1(CC2=C(C(=C(C(=O)O2)C#N)C)C(=C1)P(=O)(O)O)OCC

InChI

InChI=1S/C15H18NO6P/c1-4-15(21-5-2)6-11-13(12(7-15)23(18,19)20)9(3)10(8-16)14(17)22-11/h7H,4-6H2,1-3H3,(H2,18,19,20)