1-[(2,4-dimethylphenoxy)methyl]-N-(4-nitro-2-oxidanyl-phenyl)pyrazole-3-carboxamide

Systemtic Name: 1-[(2,4-dimethylphenoxy)methyl]-N-(4-nitro-2-oxidanyl-phenyl)pyrazole-3-carboxamide Openeye Name: 1-[(2,4-dimethylphenoxy)methyl]-N-(2-hydroxy-4-nitro-phenyl)pyrazole-3-carboxamide CAS Name: 1-[(2,4-dimethylphenoxy)methyl]-N-(2-hydroxy-4-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: 1-[(2,4-dimethylphenoxy)methyl]-N-(2-hydroxy-4-nitrophenyl)pyrazole-3-carboxamide Traditional Name: 1-[(2,4-dimethylphenoxy)methyl]-N-(2-hydroxy-4-nitro-phenyl)pyrazole-3-carboxamide Formula: C19H18N4O5 MolecularWeight: 382.37002

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18N4O5/c1-12-3-6-18(13(2)9-12)28-11-22-8-7-16(21-22)19(25)20-15-5-4-14(23(26)27)10-17(15)24/h3-10,24H,11H2,1-2H3,(H,20,25)