3-[3-(3-chlorophenyl)-4-(2,2-dicyanoethenyl)pyrazol-1-yl]propanoate

Systemtic Name: 3-[3-(3-chlorophenyl)-4-(2,2-dicyanoethenyl)pyrazol-1-yl]propanoate Openeye Name: 3-[3-(3-chlorophenyl)-4-(2,2-dicyanovinyl)pyrazol-1-yl]propanoate CAS Name: 3-[3-(3-chlorophenyl)-4-(2,2-dicyanoethenyl)-1-pyrazolyl]propanoate IUPAC Name: 3-[3-(3-chlorophenyl)-4-(2,2-dicyanoethenyl)pyrazol-1-yl]propanoate Traditional Name: 3-[3-(3-chlorophenyl)-4-(2,2-dicyanovinyl)pyrazol-1-yl]propionate Formula: C16H10ClN4O2- MolecularWeight: 325.7292

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C2=NN(C=C2C=C(C#N)C#N)CCC(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C2=NN(C=C2C=C(C#N)C#N)CCC(=O)[O-]

InChI

InChI=1S/C16H11ClN4O2/c17-14-3-1-2-12(7-14)16-13(6-11(8-18)9-19)10-21(20-16)5-4-15(22)23/h1-3,6-7,10H,4-5H2,(H,22,23)/p-1