4-chloranyl-3-[(2Z)-2-[[1-(2-cyanoethyl)-3-phenyl-pyrazol-4-yl]methylidene]hydrazinyl]benzoate

Systemtic Name: 4-chloranyl-3-[(2Z)-2-[[1-(2-cyanoethyl)-3-phenyl-pyrazol-4-yl]methylidene]hydrazinyl]benzoate Openeye Name: 4-chloro-3-[(2Z)-2-[[1-(2-cyanoethyl)-3-phenyl-pyrazol-4-yl]methylene]hydrazino]benzoate CAS Name: 4-chloro-3-[(2Z)-2-[[1-(2-cyanoethyl)-3-phenyl-4-pyrazolyl]methylidene]hydrazinyl]benzoate IUPAC Name: 4-chloro-3-[(2Z)-2-[[1-(2-cyanoethyl)-3-phenylpyrazol-4-yl]methylidene]hydrazinyl]benzoate Traditional Name: 4-chloro-3-[(N'Z)-N'-[[1-(2-cyanoethyl)-3-phenyl-pyrazol-4-yl]methylene]hydrazino]benzoate Formula: C20H15ClN5O2- MolecularWeight: 392.8184

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2C=NNC3=C(C=CC(=C3)C(=O)[O-])Cl)CCC#N

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2/C=N\NC3=C(C=CC(=C3)C(=O)[O-])Cl)CCC#N

InChI

InChI=1S/C20H16ClN5O2/c21-17-8-7-15(20(27)28)11-18(17)24-23-12-16-13-26(10-4-9-22)25-19(16)14-5-2-1-3-6-14/h1-3,5-8,11-13,24H,4,10H2,(H,27,28)/p-1/b23-12-