ethyl 3-bromanyl-4-(4-methoxyphenyl)-5-(4-methoxyphenyl)carbonyl-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 3-bromanyl-4-(4-methoxyphenyl)-5-(4-methoxyphenyl)carbonyl-1H-pyrrole-2-carboxylate Openeye Name: ethyl 3-bromo-5-(4-methoxybenzoyl)-4-(4-methoxyphenyl)-1H-pyrrole-2-carboxylate CAS Name: 3-bromo-4-(4-methoxyphenyl)-5-[(4-methoxyphenyl)-oxomethyl]-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-bromo-5-(4-methoxybenzoyl)-4-(4-methoxyphenyl)-1H-pyrrole-2-carboxylate Traditional Name: 3-bromo-4-(4-methoxyphenyl)-5-p-anisoyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C22H20BrNO5 MolecularWeight: 458.3019

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C(=O)C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC)Br

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C(=O)C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC)Br

InChI

InChI=1S/C22H20BrNO5/c1-4-29-22(26)20-18(23)17(13-5-9-15(27-2)10-6-13)19(24-20)21(25)14-7-11-16(28-3)12-8-14/h5-12,24H,4H2,1-3H3