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

Systemtic Name: 1-[(2-chloranyl-4-nitro-phenoxy)methyl]-N-(oxolan-2-ylmethyl)pyrazole-3-carboxamide Openeye Name: 1-[(2-chloro-4-nitro-phenoxy)methyl]-N-(tetrahydrofuran-2-ylmethyl)pyrazole-3-carboxamide CAS Name: 1-[(2-chloro-4-nitrophenoxy)methyl]-N-(2-oxolanylmethyl)-3-pyrazolecarboxamide IUPAC Name: 1-[(2-chloro-4-nitrophenoxy)methyl]-N-(oxolan-2-ylmethyl)pyrazole-3-carboxamide Traditional Name: 1-[(2-chloro-4-nitro-phenoxy)methyl]-N-(tetrahydrofurfuryl)pyrazole-3-carboxamide Formula: C16H17ClN4O5 MolecularWeight: 380.78298

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)C2=NN(C=C2)COC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1CC(OC1)CNC(=O)C2=NN(C=C2)COC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H17ClN4O5/c17-13-8-11(21(23)24)3-4-15(13)26-10-20-6-5-14(19-20)16(22)18-9-12-2-1-7-25-12/h3-6,8,12H,1-2,7,9-10H2,(H,18,22)