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[2-[[3,4,5-tris(bromanyl)-1H-pyrrol-2-yl]carbonyl]phenyl] heptanoate

[2-[[3,4,5-tris(bromanyl)-1H-pyrrol-2-yl]carbonyl]phenyl] heptanoate

Systemtic Name:[2-[[3,4,5-tris(bromanyl)-1H-pyrrol-2-yl]carbonyl]phenyl] heptanoate
Openeye Name:[2-(3,4,5-tribromo-1H-pyrrole-2-carbonyl)phenyl] heptanoate
CAS Name:heptanoic acid [2-[oxo-(3,4,5-tribromo-1H-pyrrol-2-yl)methyl]phenyl] ester
IUPAC Name:[2-(3,4,5-tribromo-1H-pyrrole-2-carbonyl)phenyl] heptanoate
Traditional Name:enanthic acid [2-(3,4,5-tribromo-1H-pyrrole-2-carbonyl)phenyl] ester
Formula: C18H18Br3NO3
MolecularWeight: 536.05242
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)OC1=CC=CC=C1C(=O)C2=C(C(=C(N2)Br)Br)Br


Isomeric SMILES

CCCCCCC(=O)OC1=CC=CC=C1C(=O)C2=C(C(=C(N2)Br)Br)Br


InChI

InChI=1S/C18H18Br3NO3/c1-2-3-4-5-10-13(23)25-12-9-7-6-8-11(12)17(24)16-14(19)15(20)18(21)22-16/h6-9,22H,2-5,10H2,1H3


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