1-[[2,5-dimethyl-3-nitro-4-(pyrazol-1-ylmethyl)phenyl]methyl]pyrazole

Systemtic Name: 1-[[2,5-dimethyl-3-nitro-4-(pyrazol-1-ylmethyl)phenyl]methyl]pyrazole Openeye Name: 1-[[2,5-dimethyl-3-nitro-4-(pyrazol-1-ylmethyl)phenyl]methyl]pyrazole CAS Name: 1-[[2,5-dimethyl-3-nitro-4-(1-pyrazolylmethyl)phenyl]methyl]pyrazole IUPAC Name: 1-[[2,5-dimethyl-3-nitro-4-(pyrazol-1-ylmethyl)phenyl]methyl]pyrazole Traditional Name: 1-[2,5-dimethyl-3-nitro-4-(pyrazol-1-ylmethyl)benzyl]pyrazole Formula: C16H17N5O2 MolecularWeight: 311.33848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1CN2C=CC=N2)[N+](=O)[O-])C)CN3C=CC=N3

Isomeric SMILES

CC1=CC(=C(C(=C1CN2C=CC=N2)[N+](=O)[O-])C)CN3C=CC=N3

InChI

InChI=1S/C16H17N5O2/c1-12-9-14(10-19-7-3-5-17-19)13(2)16(21(22)23)15(12)11-20-8-4-6-18-20/h3-9H,10-11H2,1-2H3