dimethyl 1-(4-methyl-3-nitro-phenyl)pyrazole-3,4-dicarboxylate

Systemtic Name: dimethyl 1-(4-methyl-3-nitro-phenyl)pyrazole-3,4-dicarboxylate Openeye Name: dimethyl 1-(4-methyl-3-nitro-phenyl)pyrazole-3,4-dicarboxylate CAS Name: 1-(4-methyl-3-nitrophenyl)pyrazole-3,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-(4-methyl-3-nitrophenyl)pyrazole-3,4-dicarboxylate Traditional Name: 1-(4-methyl-3-nitro-phenyl)pyrazole-3,4-dicarboxylic acid dimethyl ester Formula: C14H13N3O6 MolecularWeight: 319.26952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C=C(C(=N2)C(=O)OC)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)N2C=C(C(=N2)C(=O)OC)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C14H13N3O6/c1-8-4-5-9(6-11(8)17(20)21)16-7-10(13(18)22-2)12(15-16)14(19)23-3/h4-7H,1-3H3