(2E,4E)-5-(1-butylpyrrol-2-yl)-2-cyano-penta-2,4-dienoic acid

Systemtic Name: (2E,4E)-5-(1-butylpyrrol-2-yl)-2-cyano-penta-2,4-dienoic acid Openeye Name: (2E,4E)-5-(1-butylpyrrol-2-yl)-2-cyano-penta-2,4-dienoic acid CAS Name: (2E,4E)-5-(1-butyl-2-pyrrolyl)-2-cyanopenta-2,4-dienoic acid IUPAC Name: (2E,4E)-5-(1-butylpyrrol-2-yl)-2-cyanopenta-2,4-dienoic acid Traditional Name: (2E,4E)-5-(1-butylpyrrol-2-yl)-2-cyano-penta-2,4-dienoic acid Formula: C14H16N2O2 MolecularWeight: 244.28904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=CC=C1C=CC=C(C#N)C(=O)O

Isomeric SMILES

CCCCN1C=CC=C1/C=C/C=C(\C#N)/C(=O)O

InChI

InChI=1S/C14H16N2O2/c1-2-3-9-16-10-5-8-13(16)7-4-6-12(11-15)14(17)18/h4-8,10H,2-3,9H2,1H3,(H,17,18)/b7-4+,12-6+