1-[(4-chloranyl-3,5-dimethyl-phenoxy)methyl]-N-(4-methyl-2-nitro-phenyl)pyrazole-3-carboxamide

Systemtic Name: 1-[(4-chloranyl-3,5-dimethyl-phenoxy)methyl]-N-(4-methyl-2-nitro-phenyl)pyrazole-3-carboxamide Openeye Name: 1-[(4-chloro-3,5-dimethyl-phenoxy)methyl]-N-(4-methyl-2-nitro-phenyl)pyrazole-3-carboxamide CAS Name: 1-[(4-chloro-3,5-dimethylphenoxy)methyl]-N-(4-methyl-2-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: 1-[(4-chloro-3,5-dimethylphenoxy)methyl]-N-(4-methyl-2-nitrophenyl)pyrazole-3-carboxamide Traditional Name: 1-[(4-chloro-3,5-dimethyl-phenoxy)methyl]-N-(4-methyl-2-nitro-phenyl)pyrazole-3-carboxamide Formula: C20H19ClN4O4 MolecularWeight: 414.84226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=NN(C=C2)COC3=CC(=C(C(=C3)C)Cl)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=NN(C=C2)COC3=CC(=C(C(=C3)C)Cl)C)[N+](=O)[O-]

InChI

InChI=1S/C20H19ClN4O4/c1-12-4-5-16(18(8-12)25(27)28)22-20(26)17-6-7-24(23-17)11-29-15-9-13(2)19(21)14(3)10-15/h4-10H,11H2,1-3H3,(H,22,26)