2-[5-[(Z)-2-[5-azanyl-4-cyano-1-(2-hydroxyethyl)pyrazol-3-yl]-2-cyano-ethenyl]furan-2-yl]benzoate

Systemtic Name: 2-[5-[(Z)-2-[5-azanyl-4-cyano-1-(2-hydroxyethyl)pyrazol-3-yl]-2-cyano-ethenyl]furan-2-yl]benzoate Openeye Name: 2-[5-[(Z)-2-[5-amino-4-cyano-1-(2-hydroxyethyl)pyrazol-3-yl]-2-cyano-vinyl]-2-furyl]benzoate CAS Name: 2-[5-[(Z)-2-[5-amino-4-cyano-1-(2-hydroxyethyl)-3-pyrazolyl]-2-cyanoethenyl]-2-furanyl]benzoate IUPAC Name: 2-[5-[(Z)-2-[5-amino-4-cyano-1-(2-hydroxyethyl)pyrazol-3-yl]-2-cyanoethenyl]furan-2-yl]benzoate Traditional Name: 2-[5-[(Z)-2-[5-amino-4-cyano-1-(2-hydroxyethyl)pyrazol-3-yl]-2-cyano-vinyl]-2-furyl]benzoate Formula: C20H14N5O4- MolecularWeight: 388.35626

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC=C(O2)C=C(C#N)C3=NN(C(=C3C#N)N)CCO)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC=C(O2)/C=C(\C#N)/C3=NN(C(=C3C#N)N)CCO)C(=O)[O-]

InChI

InChI=1S/C20H15N5O4/c21-10-12(18-16(11-22)19(23)25(24-18)7-8-26)9-13-5-6-17(29-13)14-3-1-2-4-15(14)20(27)28/h1-6,9,26H,7-8,23H2,(H,27,28)/p-1/b12-9+