ethyl 2-[4-[(Z)-2-(5-azanyl-4-cyano-1-phenyl-pyrazol-3-yl)-2-cyano-ethenyl]-5-bromanyl-2-methoxy-phenoxy]ethanoate

Systemtic Name: ethyl 2-[4-[(Z)-2-(5-azanyl-4-cyano-1-phenyl-pyrazol-3-yl)-2-cyano-ethenyl]-5-bromanyl-2-methoxy-phenoxy]ethanoate Openeye Name: ethyl 2-[4-[(Z)-2-(5-amino-4-cyano-1-phenyl-pyrazol-3-yl)-2-cyano-vinyl]-5-bromo-2-methoxy-phenoxy]acetate CAS Name: 2-[4-[(Z)-2-(5-amino-4-cyano-1-phenyl-3-pyrazolyl)-2-cyanoethenyl]-5-bromo-2-methoxyphenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[(Z)-2-(5-amino-4-cyano-1-phenylpyrazol-3-yl)-2-cyanoethenyl]-5-bromo-2-methoxyphenoxy]acetate Traditional Name: 2-[4-[(Z)-2-(5-amino-4-cyano-1-phenyl-pyrazol-3-yl)-2-cyano-vinyl]-5-bromo-2-methoxy-phenoxy]acetic acid ethyl ester Formula: C24H20BrN5O4 MolecularWeight: 522.3507

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=C(C=C(C(=C1)Br)C=C(C#N)C2=NN(C(=C2C#N)N)C3=CC=CC=C3)OC

Isomeric SMILES

CCOC(=O)COC1=C(C=C(C(=C1)Br)/C=C(\C#N)/C2=NN(C(=C2C#N)N)C3=CC=CC=C3)OC

InChI

InChI=1S/C24H20BrN5O4/c1-3-33-22(31)14-34-21-11-19(25)15(10-20(21)32-2)9-16(12-26)23-18(13-27)24(28)30(29-23)17-7-5-4-6-8-17/h4-11H,3,14,28H2,1-2H3/b16-9+