diethyl 5-[2-(3-bromanyl-1-adamantyl)ethanoyloxymethyl]-3-methyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: diethyl 5-[2-(3-bromanyl-1-adamantyl)ethanoyloxymethyl]-3-methyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: diethyl 5-[[2-(3-bromo-1-adamantyl)acetyl]oxymethyl]-3-methyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 5-[[2-(3-bromo-1-adamantyl)-1-oxoethoxy]methyl]-3-methyl-1H-pyrrole-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[[2-(3-bromo-1-adamantyl)acetyl]oxymethyl]-3-methyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 5-[[2-(3-bromo-1-adamantyl)acetyl]oxymethyl]-3-methyl-1H-pyrrole-2,4-dicarboxylic acid diethyl ester Formula: C24H32BrNO6 MolecularWeight: 510.41798

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC)COC(=O)CC23CC4CC(C2)CC(C4)(C3)Br

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC)COC(=O)CC23CC4CC(C2)CC(C4)(C3)Br

InChI

InChI=1S/C24H32BrNO6/c1-4-30-21(28)19-14(3)20(22(29)31-5-2)26-17(19)12-32-18(27)11-23-7-15-6-16(8-23)10-24(25,9-15)13-23/h15-16,26H,4-13H2,1-3H3