N-(4-chloranyl-2-nitro-phenyl)-1-[(2,6-dimethoxyphenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-(4-chloranyl-2-nitro-phenyl)-1-[(2,6-dimethoxyphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-(4-chloro-2-nitro-phenyl)-1-[(2,6-dimethoxyphenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-(4-chloro-2-nitrophenyl)-1-[(2,6-dimethoxyphenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(4-chloro-2-nitrophenyl)-1-[(2,6-dimethoxyphenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-(4-chloro-2-nitro-phenyl)-1-[(2,6-dimethoxyphenoxy)methyl]pyrazole-3-carboxamide Formula: C19H17ClN4O6 MolecularWeight: 432.81448

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)OCN2C=CC(=N2)C(=O)NC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C(=CC=C1)OC)OCN2C=CC(=N2)C(=O)NC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H17ClN4O6/c1-28-16-4-3-5-17(29-2)18(16)30-11-23-9-8-14(22-23)19(25)21-13-7-6-12(20)10-15(13)24(26)27/h3-10H,11H2,1-2H3,(H,21,25)