ethyl 5-(3-bromophenyl)-1-(3-methoxyphenyl)-2-methyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-(3-bromophenyl)-1-(3-methoxyphenyl)-2-methyl-pyrrole-3-carboxylate Openeye Name: ethyl 5-(3-bromophenyl)-1-(3-methoxyphenyl)-2-methyl-pyrrole-3-carboxylate CAS Name: 5-(3-bromophenyl)-1-(3-methoxyphenyl)-2-methyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(3-bromophenyl)-1-(3-methoxyphenyl)-2-methylpyrrole-3-carboxylate Traditional Name: 5-(3-bromophenyl)-1-(3-methoxyphenyl)-2-methyl-pyrrole-3-carboxylic acid ethyl ester Formula: C21H20BrNO3 MolecularWeight: 414.2924

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20BrNO3/c1-4-26-21(24)19-13-20(15-7-5-8-16(22)11-15)23(14(19)2)17-9-6-10-18(12-17)25-3/h5-13H,4H2,1-3H3