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

Systemtic Name: 1-[(2-chloranyl-4-nitro-phenoxy)methyl]-N-(3-ethoxypropyl)pyrazole-3-carboxamide Openeye Name: 1-[(2-chloro-4-nitro-phenoxy)methyl]-N-(3-ethoxypropyl)pyrazole-3-carboxamide CAS Name: 1-[(2-chloro-4-nitrophenoxy)methyl]-N-(3-ethoxypropyl)-3-pyrazolecarboxamide IUPAC Name: 1-[(2-chloro-4-nitrophenoxy)methyl]-N-(3-ethoxypropyl)pyrazole-3-carboxamide Traditional Name: 1-[(2-chloro-4-nitro-phenoxy)methyl]-N-(3-ethoxypropyl)pyrazole-3-carboxamide Formula: C16H19ClN4O5 MolecularWeight: 382.79886

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19ClN4O5/c1-2-25-9-3-7-18-16(22)14-6-8-20(19-14)11-26-15-5-4-12(21(23)24)10-13(15)17/h4-6,8,10H,2-3,7,9,11H2,1H3,(H,18,22)