5-methyl-1-[(2-methylphenyl)methyl]-3-nitro-pyrazole

Systemtic Name: 5-methyl-1-[(2-methylphenyl)methyl]-3-nitro-pyrazole Openeye Name: 5-methyl-3-nitro-1-(o-tolylmethyl)pyrazole CAS Name: 5-methyl-1-[(2-methylphenyl)methyl]-3-nitropyrazole IUPAC Name: 5-methyl-1-[(2-methylphenyl)methyl]-3-nitropyrazole Traditional Name: 5-methyl-1-(2-methylbenzyl)-3-nitro-pyrazole Formula: C12H13N3O2 MolecularWeight: 231.25052

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13N3O2/c1-9-5-3-4-6-11(9)8-14-10(2)7-12(13-14)15(16)17/h3-7H,8H2,1-2H3