ethyl 2-[[(4E)-5-azanyl-4-[(4-phenyldiazenylphenyl)hydrazinylidene]pyrazol-3-yl]diazenyl]-2-cyano-ethanoate

Systemtic Name: ethyl 2-[[(4E)-5-azanyl-4-[(4-phenyldiazenylphenyl)hydrazinylidene]pyrazol-3-yl]diazenyl]-2-cyano-ethanoate Openeye Name: ethyl 2-[(4E)-5-amino-4-[(4-phenylazophenyl)hydrazono]pyrazol-3-yl]azo-2-cyano-acetate CAS Name: 2-[[(4E)-5-amino-4-[(4-phenyldiazenylphenyl)hydrazinylidene]-3-pyrazolyl]azo]-2-cyanoacetic acid ethyl ester IUPAC Name: ethyl 2-[[(4E)-5-amino-4-[(4-phenyldiazenylphenyl)hydrazinylidene]pyrazol-3-yl]diazenyl]-2-cyanoacetate Traditional Name: 2-[(4E)-5-amino-4-[(4-phenylazophenyl)hydrazono]pyrazol-3-yl]azo-2-cyano-acetic acid ethyl ester Formula: C20H18N10O2 MolecularWeight: 430.42272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)N=NC1=NN=C(C1=NNC2=CC=C(C=C2)N=NC3=CC=CC=C3)N

Isomeric SMILES

CCOC(=O)C(C#N)N=NC\1=NN=C(/C1=N\NC2=CC=C(C=C2)N=NC3=CC=CC=C3)N

InChI

InChI=1S/C20H18N10O2/c1-2-32-20(31)16(12-21)26-29-19-17(18(22)28-30-19)27-25-15-10-8-14(9-11-15)24-23-13-6-4-3-5-7-13/h3-11,16,25H,2H2,1H3,(H2,22,27,28)