3-ethoxy-5,5-dimethyl-1-(4-nitrophenyl)-4-oxidanyl-pyrazole-4-carboxamide

Systemtic Name: 3-ethoxy-5,5-dimethyl-1-(4-nitrophenyl)-4-oxidanyl-pyrazole-4-carboxamide Openeye Name: 3-ethoxy-4-hydroxy-5,5-dimethyl-1-(4-nitrophenyl)pyrazole-4-carboxamide CAS Name: 3-ethoxy-4-hydroxy-5,5-dimethyl-1-(4-nitrophenyl)-4-pyrazolecarboxamide IUPAC Name: 3-ethoxy-4-hydroxy-5,5-dimethyl-1-(4-nitrophenyl)pyrazole-4-carboxamide Traditional Name: 3-ethoxy-4-hydroxy-5,5-dimethyl-1-(4-nitrophenyl)-2-pyrazoline-4-carboxamide Formula: C14H18N4O5 MolecularWeight: 322.31652

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NN(C(C1(C(=O)N)O)(C)C)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC1=NN(C(C1(C(=O)N)O)(C)C)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H18N4O5/c1-4-23-12-14(20,11(15)19)13(2,3)17(16-12)9-5-7-10(8-6-9)18(21)22/h5-8,20H,4H2,1-3H3,(H2,15,19)