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

Systemtic Name: 3-[4-(2,2-dicyanoethenyl)-3-naphthalen-2-yl-pyrazol-1-yl]propanoic acid Openeye Name: 3-[4-(2,2-dicyanovinyl)-3-(2-naphthyl)pyrazol-1-yl]propanoic acid CAS Name: 3-[4-(2,2-dicyanoethenyl)-3-(2-naphthalenyl)-1-pyrazolyl]propanoic acid IUPAC Name: 3-[4-(2,2-dicyanoethenyl)-3-naphthalen-2-ylpyrazol-1-yl]propanoic acid Traditional Name: 3-[4-(2,2-dicyanovinyl)-3-(2-naphthyl)pyrazol-1-yl]propionic acid Formula: C20H14N4O2 MolecularWeight: 342.35076

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C3=NN(C=C3C=C(C#N)C#N)CCC(=O)O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C3=NN(C=C3C=C(C#N)C#N)CCC(=O)O

InChI

InChI=1S/C20H14N4O2/c21-11-14(12-22)9-18-13-24(8-7-19(25)26)23-20(18)17-6-5-15-3-1-2-4-16(15)10-17/h1-6,9-10,13H,7-8H2,(H,25,26)