5-azanyl-3-(hydroxymethyl)-1-[2,4,6-tris(chloranyl)phenyl]pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-3-(hydroxymethyl)-1-[2,4,6-tris(chloranyl)phenyl]pyrazole-4-carbonitrile Openeye Name: 5-amino-3-(hydroxymethyl)-1-(2,4,6-trichlorophenyl)pyrazole-4-carbonitrile CAS Name: 5-amino-3-(hydroxymethyl)-1-(2,4,6-trichlorophenyl)-4-pyrazolecarbonitrile IUPAC Name: 5-amino-3-(hydroxymethyl)-1-(2,4,6-trichlorophenyl)pyrazole-4-carbonitrile Traditional Name: 5-amino-3-methylol-1-(2,4,6-trichlorophenyl)pyrazole-4-carbonitrile Formula: C11H7Cl3N4O MolecularWeight: 317.55848

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1Cl)N2C(=C(C(=N2)CO)C#N)N)Cl)Cl

Isomeric SMILES

C1=C(C=C(C(=C1Cl)N2C(=C(C(=N2)CO)C#N)N)Cl)Cl

InChI

InChI=1S/C11H7Cl3N4O/c12-5-1-7(13)10(8(14)2-5)18-11(16)6(3-15)9(4-19)17-18/h1-2,19H,4,16H2