3-azanyl-5-[(Z)-2-[3,5-bis(iodanyl)-2-methoxy-phenyl]-1-cyano-ethenyl]-1H-pyrazole-4-carbonitrile

Systemtic Name: 3-azanyl-5-[(Z)-2-[3,5-bis(iodanyl)-2-methoxy-phenyl]-1-cyano-ethenyl]-1H-pyrazole-4-carbonitrile Openeye Name: 3-amino-5-[(Z)-1-cyano-2-(3,5-diiodo-2-methoxy-phenyl)vinyl]-1H-pyrazole-4-carbonitrile CAS Name: 3-amino-5-[(Z)-1-cyano-2-(3,5-diiodo-2-methoxyphenyl)ethenyl]-1H-pyrazole-4-carbonitrile IUPAC Name: 3-amino-5-[(Z)-1-cyano-2-(3,5-diiodo-2-methoxyphenyl)ethenyl]-1H-pyrazole-4-carbonitrile Traditional Name: 3-amino-5-[(Z)-1-cyano-2-(3,5-diiodo-2-methoxy-phenyl)vinyl]-1H-pyrazole-4-carbonitrile Formula: C14H9I2N5O MolecularWeight: 517.0631

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1C=C(C#N)C2=C(C(=NN2)N)C#N)I)I

Isomeric SMILES

COC1=C(C=C(C=C1/C=C(\C#N)/C2=C(C(=NN2)N)C#N)I)I

InChI

InChI=1S/C14H9I2N5O/c1-22-13-7(3-9(15)4-11(13)16)2-8(5-17)12-10(6-18)14(19)21-20-12/h2-4H,1H3,(H3,19,20,21)/b8-2+