(E)-2-cyano-3-[3-[(E)-2-cyano-3-oxidanyl-3-oxidanylidene-prop-1-enyl]phenyl]prop-2-enoic acid

Systemtic Name: (E)-2-cyano-3-[3-[(E)-2-cyano-3-oxidanyl-3-oxidanylidene-prop-1-enyl]phenyl]prop-2-enoic acid Openeye Name: (E)-2-cyano-3-[3-[(E)-2-cyano-3-hydroxy-3-oxo-prop-1-enyl]phenyl]prop-2-enoic acid CAS Name: (E)-2-cyano-3-[3-[(E)-2-cyano-3-hydroxy-3-oxoprop-1-enyl]phenyl]-2-propenoic acid IUPAC Name: (E)-2-cyano-3-[3-[(E)-2-cyano-3-hydroxy-3-oxoprop-1-enyl]phenyl]prop-2-enoic acid Traditional Name: (E)-2-cyano-3-[3-[(E)-2-cyano-3-hydroxy-3-keto-prop-1-enyl]phenyl]acrylic acid Formula: C14H8N2O4 MolecularWeight: 268.22432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H8N2O4/c15-7-11(13(17)18)5-9-2-1-3-10(4-9)6-12(8-16)14(19)20/h1-6H,(H,17,18)(H,19,20)/b11-5+,12-6+