(E)-2-cyano-3-(4-oxidanylidene-5-phenylmethoxy-pyran-2-yl)prop-2-enoic acid

Systemtic Name: (E)-2-cyano-3-(4-oxidanylidene-5-phenylmethoxy-pyran-2-yl)prop-2-enoic acid Openeye Name: (E)-3-(5-benzyloxy-4-oxo-pyran-2-yl)-2-cyano-prop-2-enoic acid CAS Name: (E)-2-cyano-3-(4-oxo-5-phenylmethoxy-2-pyranyl)-2-propenoic acid IUPAC Name: (E)-2-cyano-3-(4-oxo-5-phenylmethoxypyran-2-yl)prop-2-enoic acid Traditional Name: (E)-3-(5-benzoxy-4-keto-pyran-2-yl)-2-cyano-acrylic acid Formula: C16H11NO5 MolecularWeight: 297.26224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=COC(=CC2=O)C=C(C#N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=COC(=CC2=O)/C=C(\C#N)/C(=O)O

InChI

InChI=1S/C16H11NO5/c17-8-12(16(19)20)6-13-7-14(18)15(10-21-13)22-9-11-4-2-1-3-5-11/h1-7,10H,9H2,(H,19,20)/b12-6+