(1-oxidanylidene-1-phenyl-propan-2-yl) 4-azanyl-3,5-bis(bromanyl)benzoate

Systemtic Name: (1-oxidanylidene-1-phenyl-propan-2-yl) 4-azanyl-3,5-bis(bromanyl)benzoate Openeye Name: (1-methyl-2-oxo-2-phenyl-ethyl) 4-amino-3,5-dibromo-benzoate CAS Name: 4-amino-3,5-dibromobenzoic acid (1-oxo-1-phenylpropan-2-yl) ester IUPAC Name: (1-oxo-1-phenylpropan-2-yl) 4-amino-3,5-dibromobenzoate Traditional Name: 4-amino-3,5-dibromo-benzoic acid (2-keto-1-methyl-2-phenyl-ethyl) ester Formula: C16H13Br2NO3 MolecularWeight: 427.08732

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13Br2NO3/c1-9(15(20)10-5-3-2-4-6-10)22-16(21)11-7-12(17)14(19)13(18)8-11/h2-9H,19H2,1H3