ethyl 4-bromanyl-1-(2-hydroxyethyloxymethyl)-2,5-diphenyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-bromanyl-1-(2-hydroxyethyloxymethyl)-2,5-diphenyl-pyrrole-3-carboxylate Openeye Name: ethyl 4-bromo-1-(2-hydroxyethoxymethyl)-2,5-diphenyl-pyrrole-3-carboxylate CAS Name: 4-bromo-1-(2-hydroxyethoxymethyl)-2,5-diphenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-bromo-1-(2-hydroxyethoxymethyl)-2,5-diphenylpyrrole-3-carboxylate Traditional Name: 4-bromo-1-(2-hydroxyethoxymethyl)-2,5-diphenyl-pyrrole-3-carboxylic acid ethyl ester Formula: C22H22BrNO4 MolecularWeight: 444.31838

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22BrNO4/c1-2-28-22(26)18-19(23)21(17-11-7-4-8-12-17)24(15-27-14-13-25)20(18)16-9-5-3-6-10-16/h3-12,25H,2,13-15H2,1H3