methyl 4-[2-[(4-bromophenyl)methyl]phenyl]carbonyl-2,5-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 4-[2-[(4-bromophenyl)methyl]phenyl]carbonyl-2,5-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 4-[2-[(4-bromophenyl)methyl]benzoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 4-[[2-[(4-bromophenyl)methyl]phenyl]-oxomethyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 4-[2-[(4-bromophenyl)methyl]benzoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 4-[2-(4-bromobenzyl)benzoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C22H20BrNO3 MolecularWeight: 426.3031

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1)C)C(=O)OC)C(=O)C2=CC=CC=C2CC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C(C(=C(N1)C)C(=O)OC)C(=O)C2=CC=CC=C2CC3=CC=C(C=C3)Br

InChI

InChI=1S/C22H20BrNO3/c1-13-19(20(14(2)24-13)22(26)27-3)21(25)18-7-5-4-6-16(18)12-15-8-10-17(23)11-9-15/h4-11,24H,12H2,1-3H3