ethyl 4-bromanyl-1-methyl-2,5-diphenyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-bromanyl-1-methyl-2,5-diphenyl-pyrrole-3-carboxylate Openeye Name: ethyl 4-bromo-1-methyl-2,5-diphenyl-pyrrole-3-carboxylate CAS Name: 4-bromo-1-methyl-2,5-diphenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-bromo-1-methyl-2,5-diphenylpyrrole-3-carboxylate Traditional Name: 4-bromo-1-methyl-2,5-diphenyl-pyrrole-3-carboxylic acid ethyl ester Formula: C20H18BrNO2 MolecularWeight: 384.26642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18BrNO2/c1-3-24-20(23)16-17(21)19(15-12-8-5-9-13-15)22(2)18(16)14-10-6-4-7-11-14/h4-13H,3H2,1-2H3