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

Systemtic Name: 5-[5-[(Z)-2-(3-azanyl-4-cyano-1H-pyrazol-5-yl)-2-cyano-ethenyl]furan-2-yl]-2-chloranyl-benzoate Openeye Name: 5-[5-[(Z)-2-(3-amino-4-cyano-1H-pyrazol-5-yl)-2-cyano-vinyl]-2-furyl]-2-chloro-benzoate CAS Name: 5-[5-[(Z)-2-(3-amino-4-cyano-1H-pyrazol-5-yl)-2-cyanoethenyl]-2-furanyl]-2-chlorobenzoate IUPAC Name: 5-[5-[(Z)-2-(3-amino-4-cyano-1H-pyrazol-5-yl)-2-cyanoethenyl]furan-2-yl]-2-chlorobenzoate Traditional Name: 5-[5-[(Z)-2-(3-amino-4-cyano-1H-pyrazol-5-yl)-2-cyano-vinyl]-2-furyl]-2-chloro-benzoate Formula: C18H9ClN5O3- MolecularWeight: 378.74876

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C2=CC=C(O2)C=C(C#N)C3=C(C(=NN3)N)C#N)C(=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1C2=CC=C(O2)/C=C(\C#N)/C3=C(C(=NN3)N)C#N)C(=O)[O-])Cl

InChI

InChI=1S/C18H10ClN5O3/c19-14-3-1-9(6-12(14)18(25)26)15-4-2-11(27-15)5-10(7-20)16-13(8-21)17(22)24-23-16/h1-6H,(H,25,26)(H3,22,23,24)/p-1/b10-5+