(phenylmethyl) 4-[(Z)-1,2-bis(bromanyl)ethenyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate

Systemtic Name: (phenylmethyl) 4-[(Z)-1,2-bis(bromanyl)ethenyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: benzyl 4-[(Z)-1,2-dibromovinyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-[(Z)-1,2-dibromoethenyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[(Z)-1,2-dibromoethenyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-[(Z)-1,2-dibromovinyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid benzyl ester Formula: C16H15Br2NO2 MolecularWeight: 413.1038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=CBr)Br)C)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC1=C(NC(=C1/C(=C/Br)/Br)C)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C16H15Br2NO2/c1-10-14(13(18)8-17)11(2)19-15(10)16(20)21-9-12-6-4-3-5-7-12/h3-8,19H,9H2,1-2H3/b13-8-