ethyl 1-[1,3-bis(oxidanyl)propan-2-yloxymethyl]-4-bromanyl-2,5-diphenyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 1-[1,3-bis(oxidanyl)propan-2-yloxymethyl]-4-bromanyl-2,5-diphenyl-pyrrole-3-carboxylate Openeye Name: ethyl 4-bromo-1-[[2-hydroxy-1-(hydroxymethyl)ethoxy]methyl]-2,5-diphenyl-pyrrole-3-carboxylate CAS Name: 4-bromo-1-(1,3-dihydroxypropan-2-yloxymethyl)-2,5-diphenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-bromo-1-(1,3-dihydroxypropan-2-yloxymethyl)-2,5-diphenylpyrrole-3-carboxylate Traditional Name: 4-bromo-1-[(2-hydroxy-1-methylol-ethoxy)methyl]-2,5-diphenyl-pyrrole-3-carboxylic acid ethyl ester Formula: C23H24BrNO5 MolecularWeight: 474.34436

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1Br)C2=CC=CC=C2)COC(CO)CO)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1Br)C2=CC=CC=C2)COC(CO)CO)C3=CC=CC=C3

InChI

InChI=1S/C23H24BrNO5/c1-2-29-23(28)19-20(24)22(17-11-7-4-8-12-17)25(15-30-18(13-26)14-27)21(19)16-9-5-3-6-10-16/h3-12,18,26-27H,2,13-15H2,1H3