ethyl 4-bromanyl-2-(bromomethyl)-1-methyl-5-(4-methylphenyl)carbonyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-bromanyl-2-(bromomethyl)-1-methyl-5-(4-methylphenyl)carbonyl-pyrrole-3-carboxylate Openeye Name: ethyl 4-bromo-2-(bromomethyl)-1-methyl-5-(4-methylbenzoyl)pyrrole-3-carboxylate CAS Name: 4-bromo-2-(bromomethyl)-1-methyl-5-[(4-methylphenyl)-oxomethyl]-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-bromo-2-(bromomethyl)-1-methyl-5-(4-methylbenzoyl)pyrrole-3-carboxylate Traditional Name: 4-bromo-2-(bromomethyl)-1-methyl-5-p-toluoyl-pyrrole-3-carboxylic acid ethyl ester Formula: C17H17Br2NO3 MolecularWeight: 443.12978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17Br2NO3/c1-4-23-17(22)13-12(9-18)20(3)15(14(13)19)16(21)11-7-5-10(2)6-8-11/h5-8H,4,9H2,1-3H3