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

Systemtic Name: 1-[[2,3-bis(chloranyl)phenyl]methyl]-5-methyl-3-nitro-pyrazole-4-carbonitrile Openeye Name: 1-[(2,3-dichlorophenyl)methyl]-5-methyl-3-nitro-pyrazole-4-carbonitrile CAS Name: 1-[(2,3-dichlorophenyl)methyl]-5-methyl-3-nitro-4-pyrazolecarbonitrile IUPAC Name: 1-[(2,3-dichlorophenyl)methyl]-5-methyl-3-nitropyrazole-4-carbonitrile Traditional Name: 1-(2,3-dichlorobenzyl)-5-methyl-3-nitro-pyrazole-4-carbonitrile Formula: C12H8Cl2N4O2 MolecularWeight: 311.12352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=C(C(=CC=C2)Cl)Cl)[N+](=O)[O-])C#N

Isomeric SMILES

CC1=C(C(=NN1CC2=C(C(=CC=C2)Cl)Cl)[N+](=O)[O-])C#N

InChI

InChI=1S/C12H8Cl2N4O2/c1-7-9(5-15)12(18(19)20)16-17(7)6-8-3-2-4-10(13)11(8)14/h2-4H,6H2,1H3