ethyl 4-[2-[(3-bromanyl-1-adamantyl)carbonyloxy]ethanoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-[2-[(3-bromanyl-1-adamantyl)carbonyloxy]ethanoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-[2-(3-bromoadamantane-1-carbonyl)oxyacetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 4-[2-[(3-bromo-1-adamantyl)-oxomethoxy]-1-oxoethyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(3-bromoadamantane-1-carbonyl)oxyacetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 4-[2-(3-bromoadamantane-1-carbonyl)oxyacetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C22H28BrNO5 MolecularWeight: 466.36542

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C(=O)COC(=O)C23CC4CC(C2)CC(C4)(C3)Br)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C(=O)COC(=O)C23CC4CC(C2)CC(C4)(C3)Br)C)C

InChI

InChI=1S/C22H28BrNO5/c1-4-28-19(26)18-13(3)24-12(2)17(18)16(25)10-29-20(27)21-6-14-5-15(7-21)9-22(23,8-14)11-21/h14-15,24H,4-11H2,1-3H3