methyl 4-[(6-bromanyl-1,3-benzodioxol-5-yl)methylidene]-1-(furan-2-ylmethyl)-2-methyl-5-oxidanylidene-pyrrole-3-carboxylate

Systemtic Name: methyl 4-[(6-bromanyl-1,3-benzodioxol-5-yl)methylidene]-1-(furan-2-ylmethyl)-2-methyl-5-oxidanylidene-pyrrole-3-carboxylate Openeye Name: methyl 4-[(6-bromo-1,3-benzodioxol-5-yl)methylene]-1-(2-furylmethyl)-2-methyl-5-oxo-pyrrole-3-carboxylate CAS Name: 4-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-1-(2-furanylmethyl)-2-methyl-5-oxo-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-1-(furan-2-ylmethyl)-2-methyl-5-oxopyrrole-3-carboxylate Traditional Name: 4-[(6-bromo-1,3-benzodioxol-5-yl)methylene]-1-(2-furfuryl)-5-keto-2-methyl-2-pyrroline-3-carboxylic acid methyl ester Formula: C20H16BrNO6 MolecularWeight: 446.24814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC2=CC3=C(C=C2Br)OCO3)C(=O)N1CC4=CC=CO4)C(=O)OC

Isomeric SMILES

CC1=C(C(=CC2=CC3=C(C=C2Br)OCO3)C(=O)N1CC4=CC=CO4)C(=O)OC

InChI

InChI=1S/C20H16BrNO6/c1-11-18(20(24)25-2)14(19(23)22(11)9-13-4-3-5-26-13)6-12-7-16-17(8-15(12)21)28-10-27-16/h3-8H,9-10H2,1-2H3