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

Systemtic Name: 4-chloranyl-1-[(2-methylphenyl)methyl]-3-nitro-pyrazole Openeye Name: 4-chloro-3-nitro-1-(o-tolylmethyl)pyrazole CAS Name: 4-chloro-1-[(2-methylphenyl)methyl]-3-nitropyrazole IUPAC Name: 4-chloro-1-[(2-methylphenyl)methyl]-3-nitropyrazole Traditional Name: 4-chloro-1-(2-methylbenzyl)-3-nitro-pyrazole Formula: C11H10ClN3O2 MolecularWeight: 251.669

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H10ClN3O2/c1-8-4-2-3-5-9(8)6-14-7-10(12)11(13-14)15(16)17/h2-5,7H,6H2,1H3