N-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]-2-methyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]-2-methyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]-2-methyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-[1-[(2-chlorophenyl)methyl]-4-pyrazolyl]-2-methyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]-2-methyl-4-nitropyrazole-3-carboxamide Traditional Name: N-[1-(2-chlorobenzyl)pyrazol-4-yl]-2-methyl-4-nitro-pyrazole-3-carboxamide Formula: C15H13ClN6O3 MolecularWeight: 360.75512

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)[N+](=O)[O-])C(=O)NC2=CN(N=C2)CC3=CC=CC=C3Cl

Isomeric SMILES

CN1C(=C(C=N1)[N+](=O)[O-])C(=O)NC2=CN(N=C2)CC3=CC=CC=C3Cl

InChI

InChI=1S/C15H13ClN6O3/c1-20-14(13(7-17-20)22(24)25)15(23)19-11-6-18-21(9-11)8-10-4-2-3-5-12(10)16/h2-7,9H,8H2,1H3,(H,19,23)