(3E)-2-tert-butyl-3-(nitrosomethylidene)-1H-pyrazole-4-carboxylic acid

Systemtic Name: (3E)-2-tert-butyl-3-(nitrosomethylidene)-1H-pyrazole-4-carboxylic acid Openeye Name: (3E)-2-tert-butyl-3-(nitrosomethylene)-1H-pyrazole-4-carboxylic acid CAS Name: (3E)-2-tert-butyl-3-(nitrosomethylidene)-1H-pyrazole-4-carboxylic acid IUPAC Name: (3E)-2-tert-butyl-3-(nitrosomethylidene)-1H-pyrazole-4-carboxylic acid Traditional Name: (5E)-1-tert-butyl-5-(nitrosomethylene)-3-pyrazoline-4-carboxylic acid Formula: C9H13N3O3 MolecularWeight: 211.21782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=CN=O)C(=CN1)C(=O)O

Isomeric SMILES

CC(C)(C)N1/C(=C/N=O)/C(=CN1)C(=O)O

InChI

InChI=1S/C9H13N3O3/c1-9(2,3)12-7(5-11-15)6(4-10-12)8(13)14/h4-5,10H,1-3H3,(H,13,14)/b7-5+