5-azanyl-1-[2,4-bis(chloranyl)-3-methoxy-phenyl]pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-1-[2,4-bis(chloranyl)-3-methoxy-phenyl]pyrazole-4-carbonitrile Openeye Name: 5-amino-1-(2,4-dichloro-3-methoxy-phenyl)pyrazole-4-carbonitrile CAS Name: 5-amino-1-(2,4-dichloro-3-methoxyphenyl)-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-(2,4-dichloro-3-methoxyphenyl)pyrazole-4-carbonitrile Traditional Name: 5-amino-1-(2,4-dichloro-3-methoxy-phenyl)pyrazole-4-carbonitrile Formula: C11H8Cl2N4O MolecularWeight: 283.11342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1Cl)N2C(=C(C=N2)C#N)N)Cl

Isomeric SMILES

COC1=C(C=CC(=C1Cl)N2C(=C(C=N2)C#N)N)Cl

InChI

InChI=1S/C11H8Cl2N4O/c1-18-10-7(12)2-3-8(9(10)13)17-11(15)6(4-14)5-16-17/h2-3,5H,15H2,1H3