(2E,4E,6E)-2-cyano-7-(1-ethylpyrrol-3-yl)hepta-2,4,6-trienoic acid

Systemtic Name: (2E,4E,6E)-2-cyano-7-(1-ethylpyrrol-3-yl)hepta-2,4,6-trienoic acid Openeye Name: (2E,4E,6E)-2-cyano-7-(1-ethylpyrrol-3-yl)hepta-2,4,6-trienoic acid CAS Name: (2E,4E,6E)-2-cyano-7-(1-ethyl-3-pyrrolyl)hepta-2,4,6-trienoic acid IUPAC Name: (2E,4E,6E)-2-cyano-7-(1-ethylpyrrol-3-yl)hepta-2,4,6-trienoic acid Traditional Name: (2E,4E,6E)-2-cyano-7-(1-ethylpyrrol-3-yl)hepta-2,4,6-trienoic acid Formula: C14H14N2O2 MolecularWeight: 242.27316

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CC(=C1)C=CC=CC=C(C#N)C(=O)O

Isomeric SMILES

CCN1C=CC(=C1)/C=C/C=C/C=C(\C#N)/C(=O)O

InChI

InChI=1S/C14H14N2O2/c1-2-16-9-8-12(11-16)6-4-3-5-7-13(10-15)14(17)18/h3-9,11H,2H2,1H3,(H,17,18)/b5-3+,6-4+,13-7+