(5Z)-5-[(3-oxidanylidene-5-propan-2-yloxy-1,2-dihydropyrazol-4-yl)methylidene]pyrrole-2-carboxylic acid

Systemtic Name: (5Z)-5-[(3-oxidanylidene-5-propan-2-yloxy-1,2-dihydropyrazol-4-yl)methylidene]pyrrole-2-carboxylic acid Openeye Name: (5Z)-5-[(3-isopropoxy-5-oxo-1,2-dihydropyrazol-4-yl)methylene]pyrrole-2-carboxylic acid CAS Name: (5Z)-5-[(3-oxo-5-propan-2-yloxy-1,2-dihydropyrazol-4-yl)methylidene]-2-pyrrolecarboxylic acid IUPAC Name: (5Z)-5-[(3-oxo-5-propan-2-yloxy-1,2-dihydropyrazol-4-yl)methylidene]pyrrole-2-carboxylic acid Traditional Name: (5Z)-5-[(3-isopropoxy-5-keto-3-pyrazolin-4-yl)methylene]pyrrole-2-carboxylic acid Formula: C12H13N3O4 MolecularWeight: 263.24932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C(=O)NN1)C=C2C=CC(=N2)C(=O)O

Isomeric SMILES

CC(C)OC1=C(C(=O)NN1)/C=C\2/C=CC(=N2)C(=O)O

InChI

InChI=1S/C12H13N3O4/c1-6(2)19-11-8(10(16)14-15-11)5-7-3-4-9(13-7)12(17)18/h3-6H,1-2H3,(H,17,18)(H2,14,15,16)/b7-5-