(E)-2-cyano-3-(3-methoxy-4-oxidanyl-phenyl)but-2-enoic acid

Systemtic Name: (E)-2-cyano-3-(3-methoxy-4-oxidanyl-phenyl)but-2-enoic acid Openeye Name: (E)-2-cyano-3-(4-hydroxy-3-methoxy-phenyl)but-2-enoic acid CAS Name: (E)-2-cyano-3-(4-hydroxy-3-methoxyphenyl)-2-butenoic acid IUPAC Name: (E)-2-cyano-3-(4-hydroxy-3-methoxyphenyl)but-2-enoic acid Traditional Name: (E)-2-cyano-3-(4-hydroxy-3-methoxy-phenyl)but-2-enoic acid Formula: C12H11NO4 MolecularWeight: 233.22004

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)C(=O)O)C1=CC(=C(C=C1)O)OC

Isomeric SMILES

C/C(=C(/C#N)\C(=O)O)/C1=CC(=C(C=C1)O)OC

InChI

InChI=1S/C12H11NO4/c1-7(9(6-13)12(15)16)8-3-4-10(14)11(5-8)17-2/h3-5,14H,1-2H3,(H,15,16)/b9-7+