1-[(3,5-dimethylphenoxy)methyl]-N-(3-methoxy-5-nitro-phenyl)pyrazole-3-carboxamide

Systemtic Name: 1-[(3,5-dimethylphenoxy)methyl]-N-(3-methoxy-5-nitro-phenyl)pyrazole-3-carboxamide Openeye Name: 1-[(3,5-dimethylphenoxy)methyl]-N-(3-methoxy-5-nitro-phenyl)pyrazole-3-carboxamide CAS Name: 1-[(3,5-dimethylphenoxy)methyl]-N-(3-methoxy-5-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: 1-[(3,5-dimethylphenoxy)methyl]-N-(3-methoxy-5-nitrophenyl)pyrazole-3-carboxamide Traditional Name: 1-[(3,5-dimethylphenoxy)methyl]-N-(3-methoxy-5-nitro-phenyl)pyrazole-3-carboxamide Formula: C20H20N4O5 MolecularWeight: 396.3966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCN2C=CC(=N2)C(=O)NC3=CC(=CC(=C3)OC)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1)OCN2C=CC(=N2)C(=O)NC3=CC(=CC(=C3)OC)[N+](=O)[O-])C

InChI

InChI=1S/C20H20N4O5/c1-13-6-14(2)8-18(7-13)29-12-23-5-4-19(22-23)20(25)21-15-9-16(24(26)27)11-17(10-15)28-3/h4-11H,12H2,1-3H3,(H,21,25)