N-[1-[[2,6-bis(chloranyl)phenyl]methyl]pyrazol-3-yl]-1-ethyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-[1-[[2,6-bis(chloranyl)phenyl]methyl]pyrazol-3-yl]-1-ethyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-[1-[(2,6-dichlorophenyl)methyl]pyrazol-3-yl]-1-ethyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-[1-[(2,6-dichlorophenyl)methyl]-3-pyrazolyl]-1-ethyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-[1-[(2,6-dichlorophenyl)methyl]pyrazol-3-yl]-1-ethyl-4-nitropyrazole-3-carboxamide Traditional Name: N-[1-(2,6-dichlorobenzyl)pyrazol-3-yl]-1-ethyl-4-nitro-pyrazole-3-carboxamide Formula: C16H14Cl2N6O3 MolecularWeight: 409.22676

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NC2=NN(C=C2)CC3=C(C=CC=C3Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NC2=NN(C=C2)CC3=C(C=CC=C3Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H14Cl2N6O3/c1-2-22-9-13(24(26)27)15(21-22)16(25)19-14-6-7-23(20-14)8-10-11(17)4-3-5-12(10)18/h3-7,9H,2,8H2,1H3,(H,19,20,25)