(4-chlorophenyl)-(4-nitro-3-propyl-pyrazol-1-yl)methanone

Systemtic Name: (4-chlorophenyl)-(4-nitro-3-propyl-pyrazol-1-yl)methanone Openeye Name: (4-chlorophenyl)-(4-nitro-3-propyl-pyrazol-1-yl)methanone CAS Name: (4-chlorophenyl)-(4-nitro-3-propyl-1-pyrazolyl)methanone IUPAC Name: (4-chlorophenyl)-(4-nitro-3-propylpyrazol-1-yl)methanone Traditional Name: (4-chlorophenyl)-(4-nitro-3-propyl-pyrazol-1-yl)methanone Formula: C13H12ClN3O3 MolecularWeight: 293.70568

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C=C1[N+](=O)[O-])C(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCC1=NN(C=C1[N+](=O)[O-])C(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H12ClN3O3/c1-2-3-11-12(17(19)20)8-16(15-11)13(18)9-4-6-10(14)7-5-9/h4-8H,2-3H2,1H3