N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-[1-[(3,4-diethoxyphenyl)methyl]-4-pyrazolyl]-2,5-dimethyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-2,5-dimethyl-4-nitropyrazole-3-carboxamide Traditional Name: N-[1-(3,4-diethoxybenzyl)pyrazol-4-yl]-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide Formula: C20H24N6O5 MolecularWeight: 428.44176

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CN2C=C(C=N2)NC(=O)C3=C(C(=NN3C)C)[N+](=O)[O-])OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CN2C=C(C=N2)NC(=O)C3=C(C(=NN3C)C)[N+](=O)[O-])OCC

InChI

InChI=1S/C20H24N6O5/c1-5-30-16-8-7-14(9-17(16)31-6-2)11-25-12-15(10-21-25)22-20(27)19-18(26(28)29)13(3)23-24(19)4/h7-10,12H,5-6,11H2,1-4H3,(H,22,27)