methyl (3S,4E)-4-[(6-bromanyl-1,3-benzodioxol-5-yl)methylidene]-2-methylidene-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: methyl (3S,4E)-4-[(6-bromanyl-1,3-benzodioxol-5-yl)methylidene]-2-methylidene-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: methyl (3S,4E)-4-[(6-bromo-1,3-benzodioxol-5-yl)methylene]-2-methylene-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S,4E)-4-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-2-methylene-5-oxo-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (3S,4E)-4-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-2-methylidene-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S,4E)-4-[(6-bromo-1,3-benzodioxol-5-yl)methylene]-5-keto-2-methylene-pyrrolidine-3-carboxylic acid methyl ester Formula: C15H12BrNO5 MolecularWeight: 366.16348

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(=C)NC(=O)C1=CC2=CC3=C(C=C2Br)OCO3

Isomeric SMILES

COC(=O)[C@@H]\1C(=C)NC(=O)/C1=C/C2=CC3=C(C=C2Br)OCO3

InChI

InChI=1S/C15H12BrNO5/c1-7-13(15(19)20-2)9(14(18)17-7)3-8-4-11-12(5-10(8)16)22-6-21-11/h3-5,13H,1,6H2,2H3,(H,17,18)/b9-3+/t13-/m1/s1