4-chloranyl-3-nitro-N-[1-(4-propan-2-ylphenyl)propyl]-1H-pyrazole-5-carboxamide

Systemtic Name: 4-chloranyl-3-nitro-N-[1-(4-propan-2-ylphenyl)propyl]-1H-pyrazole-5-carboxamide Openeye Name: 4-chloro-N-[1-(4-isopropylphenyl)propyl]-3-nitro-1H-pyrazole-5-carboxamide CAS Name: 4-chloro-3-nitro-N-[1-(4-propan-2-ylphenyl)propyl]-1H-pyrazole-5-carboxamide IUPAC Name: 4-chloro-3-nitro-N-[1-(4-propan-2-ylphenyl)propyl]-1H-pyrazole-5-carboxamide Traditional Name: 4-chloro-3-nitro-N-(1-p-cumenylpropyl)-1H-pyrazole-5-carboxamide Formula: C16H19ClN4O3 MolecularWeight: 350.80006

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)C(C)C)NC(=O)C2=C(C(=NN2)[N+](=O)[O-])Cl

Isomeric SMILES

CCC(C1=CC=C(C=C1)C(C)C)NC(=O)C2=C(C(=NN2)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H19ClN4O3/c1-4-12(11-7-5-10(6-8-11)9(2)3)18-16(22)14-13(17)15(20-19-14)21(23)24/h5-9,12H,4H2,1-3H3,(H,18,22)(H,19,20)