(E)-2-cyano-3-(4-oxidanylidenecyclohexa-1,5-dien-1-yl)prop-2-enoic acid

Systemtic Name: (E)-2-cyano-3-(4-oxidanylidenecyclohexa-1,5-dien-1-yl)prop-2-enoic acid Openeye Name: (E)-2-cyano-3-(4-oxocyclohexa-1,5-dien-1-yl)prop-2-enoic acid CAS Name: (E)-2-cyano-3-(4-oxo-1-cyclohexa-1,5-dienyl)-2-propenoic acid IUPAC Name: (E)-2-cyano-3-(4-oxocyclohexa-1,5-dien-1-yl)prop-2-enoic acid Traditional Name: (E)-2-cyano-3-(4-ketocyclohexa-1,5-dien-1-yl)acrylic acid Formula: C10H7NO3 MolecularWeight: 189.16748

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(C=CC1=O)C=C(C#N)C(=O)O

Isomeric SMILES

C1C=C(C=CC1=O)/C=C(\C#N)/C(=O)O

InChI

InChI=1S/C10H7NO3/c11-6-8(10(13)14)5-7-1-3-9(12)4-2-7/h1-3,5H,4H2,(H,13,14)/b8-5+