(5Z)-1-hexyl-5-[(2-methylpropan-2-yl)oxy-oxidanyl-methylidene]-4-oxidanylidene-pyrrole-3-carboxylic acid

Systemtic Name: (5Z)-1-hexyl-5-[(2-methylpropan-2-yl)oxy-oxidanyl-methylidene]-4-oxidanylidene-pyrrole-3-carboxylic acid Openeye Name: (5Z)-5-[tert-butoxy(hydroxy)methylene]-1-hexyl-4-oxo-pyrrole-3-carboxylic acid CAS Name: (5Z)-1-hexyl-5-[hydroxy-[(2-methylpropan-2-yl)oxy]methylidene]-4-oxo-3-pyrrolecarboxylic acid IUPAC Name: (5Z)-1-hexyl-5-[hydroxy-[(2-methylpropan-2-yl)oxy]methylidene]-4-oxopyrrole-3-carboxylic acid Traditional Name: (5Z)-5-[tert-butoxy(hydroxy)methylene]-1-hexyl-4-keto-2-pyrroline-3-carboxylic acid Formula: C16H25NO5 MolecularWeight: 311.3734

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C=C(C(=O)C1=C(O)OC(C)(C)C)C(=O)O

Isomeric SMILES

CCCCCCN\1C=C(C(=O)/C1=C(\O)/OC(C)(C)C)C(=O)O

InChI

InChI=1S/C16H25NO5/c1-5-6-7-8-9-17-10-11(14(19)20)13(18)12(17)15(21)22-16(2,3)4/h10,21H,5-9H2,1-4H3,(H,19,20)/b15-12-