methyl 4-[[(3-bromanyl-4-iodanyl-phenyl)carbonyl-methyl-amino]methyl]benzoate

Systemtic Name: methyl 4-[[(3-bromanyl-4-iodanyl-phenyl)carbonyl-methyl-amino]methyl]benzoate Openeye Name: methyl 4-[[(3-bromo-4-iodo-benzoyl)-methyl-amino]methyl]benzoate CAS Name: 4-[[[(3-bromo-4-iodophenyl)-oxomethyl]-methylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(3-bromo-4-iodobenzoyl)-methylamino]methyl]benzoate Traditional Name: 4-[[(3-bromo-4-iodo-benzoyl)-methyl-amino]methyl]benzoic acid methyl ester Formula: C17H15BrINO3 MolecularWeight: 488.11437

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)C(=O)OC)C(=O)C2=CC(=C(C=C2)I)Br

Isomeric SMILES

CN(CC1=CC=C(C=C1)C(=O)OC)C(=O)C2=CC(=C(C=C2)I)Br

InChI

InChI=1S/C17H15BrINO3/c1-20(16(21)13-7-8-15(19)14(18)9-13)10-11-3-5-12(6-4-11)17(22)23-2/h3-9H,10H2,1-2H3