[2,4-bis(bromanyl)-6-[[(4-methylphenyl)carbonylamino]methyl]phenyl] furan-2-carboxylate

Systemtic Name: [2,4-bis(bromanyl)-6-[[(4-methylphenyl)carbonylamino]methyl]phenyl] furan-2-carboxylate Openeye Name: [2,4-dibromo-6-[[(4-methylbenzoyl)amino]methyl]phenyl] furan-2-carboxylate CAS Name: 2-furancarboxylic acid [2,4-dibromo-6-[[[(4-methylphenyl)-oxomethyl]amino]methyl]phenyl] ester IUPAC Name: [2,4-dibromo-6-[[(4-methylbenzoyl)amino]methyl]phenyl] furan-2-carboxylate Traditional Name: furan-2-carboxylic acid [2,4-dibromo-6-[(p-toluoylamino)methyl]phenyl] ester Formula: C20H15Br2NO4 MolecularWeight: 493.1454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NCC2=CC(=CC(=C2OC(=O)C3=CC=CO3)Br)Br

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NCC2=CC(=CC(=C2OC(=O)C3=CC=CO3)Br)Br

InChI

InChI=1S/C20H15Br2NO4/c1-12-4-6-13(7-5-12)19(24)23-11-14-9-15(21)10-16(22)18(14)27-20(25)17-3-2-8-26-17/h2-10H,11H2,1H3,(H,23,24)