1-[(4-chloranyl-3,5-dimethyl-phenoxy)methyl]-3,5-dimethyl-4-nitro-pyrazole

Systemtic Name: 1-[(4-chloranyl-3,5-dimethyl-phenoxy)methyl]-3,5-dimethyl-4-nitro-pyrazole Openeye Name: 1-[(4-chloro-3,5-dimethyl-phenoxy)methyl]-3,5-dimethyl-4-nitro-pyrazole CAS Name: 1-[(4-chloro-3,5-dimethylphenoxy)methyl]-3,5-dimethyl-4-nitropyrazole IUPAC Name: 1-[(4-chloro-3,5-dimethylphenoxy)methyl]-3,5-dimethyl-4-nitropyrazole Traditional Name: 1-[(4-chloro-3,5-dimethyl-phenoxy)methyl]-3,5-dimethyl-4-nitro-pyrazole Formula: C14H16ClN3O3 MolecularWeight: 309.74814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OCN2C(=C(C(=N2)C)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OCN2C(=C(C(=N2)C)[N+](=O)[O-])C

InChI

InChI=1S/C14H16ClN3O3/c1-8-5-12(6-9(2)13(8)15)21-7-17-11(4)14(18(19)20)10(3)16-17/h5-6H,7H2,1-4H3