3-[4-(2,2-dicyanoethenyl)-3-thiophen-2-yl-pyrazol-1-yl]propanoic acid

Systemtic Name: 3-[4-(2,2-dicyanoethenyl)-3-thiophen-2-yl-pyrazol-1-yl]propanoic acid Openeye Name: 3-[4-(2,2-dicyanovinyl)-3-(2-thienyl)pyrazol-1-yl]propanoic acid CAS Name: 3-[4-(2,2-dicyanoethenyl)-3-thiophen-2-yl-1-pyrazolyl]propanoic acid IUPAC Name: 3-[4-(2,2-dicyanoethenyl)-3-thiophen-2-ylpyrazol-1-yl]propanoic acid Traditional Name: 3-[4-(2,2-dicyanovinyl)-3-(2-thienyl)pyrazol-1-yl]propionic acid Formula: C14H10N4O2S MolecularWeight: 298.3198

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NN(C=C2C=C(C#N)C#N)CCC(=O)O

Isomeric SMILES

C1=CSC(=C1)C2=NN(C=C2C=C(C#N)C#N)CCC(=O)O

InChI

InChI=1S/C14H10N4O2S/c15-7-10(8-16)6-11-9-18(4-3-13(19)20)17-14(11)12-2-1-5-21-12/h1-2,5-6,9H,3-4H2,(H,19,20)