1-[(2-chloranyl-4-nitro-phenoxy)methyl]-N-(3-methoxypropyl)pyrazole-3-carboxamide

Systemtic Name: 1-[(2-chloranyl-4-nitro-phenoxy)methyl]-N-(3-methoxypropyl)pyrazole-3-carboxamide Openeye Name: 1-[(2-chloro-4-nitro-phenoxy)methyl]-N-(3-methoxypropyl)pyrazole-3-carboxamide CAS Name: 1-[(2-chloro-4-nitrophenoxy)methyl]-N-(3-methoxypropyl)-3-pyrazolecarboxamide IUPAC Name: 1-[(2-chloro-4-nitrophenoxy)methyl]-N-(3-methoxypropyl)pyrazole-3-carboxamide Traditional Name: 1-[(2-chloro-4-nitro-phenoxy)methyl]-N-(3-methoxypropyl)pyrazole-3-carboxamide Formula: C15H17ClN4O5 MolecularWeight: 368.77228

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)C1=NN(C=C1)COC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

COCCCNC(=O)C1=NN(C=C1)COC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H17ClN4O5/c1-24-8-2-6-17-15(21)13-5-7-19(18-13)10-25-14-4-3-11(20(22)23)9-12(14)16/h3-5,7,9H,2,6,8,10H2,1H3,(H,17,21)