1-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]-2-(4-bromanyl-2-chloranyl-phenoxy)ethanone

Systemtic Name: 1-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]-2-(4-bromanyl-2-chloranyl-phenoxy)ethanone Openeye Name: 1-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]-2-(4-bromo-2-chloro-phenoxy)ethanone CAS Name: 1-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-3-pyrrolyl]-2-(4-bromo-2-chlorophenoxy)ethanone IUPAC Name: 1-[1-(1,3-benzodioxol-5-yl)-2,5-dimethylpyrrol-3-yl]-2-(4-bromo-2-chlorophenoxy)ethanone Traditional Name: 1-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]-2-(4-bromo-2-chloro-phenoxy)ethanone Formula: C21H17BrClNO4 MolecularWeight: 462.72098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC3=C(C=C2)OCO3)C)C(=O)COC4=C(C=C(C=C4)Br)Cl

Isomeric SMILES

CC1=CC(=C(N1C2=CC3=C(C=C2)OCO3)C)C(=O)COC4=C(C=C(C=C4)Br)Cl

InChI

InChI=1S/C21H17BrClNO4/c1-12-7-16(18(25)10-26-19-5-3-14(22)8-17(19)23)13(2)24(12)15-4-6-20-21(9-15)28-11-27-20/h3-9H,10-11H2,1-2H3