1-[(4-tert-butylphenoxy)methyl]-N-(3-methoxy-5-nitro-phenyl)pyrazole-3-carboxamide

Systemtic Name: 1-[(4-tert-butylphenoxy)methyl]-N-(3-methoxy-5-nitro-phenyl)pyrazole-3-carboxamide Openeye Name: 1-[(4-tert-butylphenoxy)methyl]-N-(3-methoxy-5-nitro-phenyl)pyrazole-3-carboxamide CAS Name: 1-[(4-tert-butylphenoxy)methyl]-N-(3-methoxy-5-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: 1-[(4-tert-butylphenoxy)methyl]-N-(3-methoxy-5-nitrophenyl)pyrazole-3-carboxamide Traditional Name: 1-[(4-tert-butylphenoxy)methyl]-N-(3-methoxy-5-nitro-phenyl)pyrazole-3-carboxamide Formula: C22H24N4O5 MolecularWeight: 424.44976

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCN2C=CC(=N2)C(=O)NC3=CC(=CC(=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCN2C=CC(=N2)C(=O)NC3=CC(=CC(=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O5/c1-22(2,3)15-5-7-18(8-6-15)31-14-25-10-9-20(24-25)21(27)23-16-11-17(26(28)29)13-19(12-16)30-4/h5-13H,14H2,1-4H3,(H,23,27)