methyl 4-[[2-(4-bromophenyl)ethanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[2-(4-bromophenyl)ethanoylamino]methyl]benzoate Openeye Name: methyl 4-[[[2-(4-bromophenyl)acetyl]amino]methyl]benzoate CAS Name: 4-[[[2-(4-bromophenyl)-1-oxoethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-(4-bromophenyl)acetyl]amino]methyl]benzoate Traditional Name: 4-[[[2-(4-bromophenyl)acetyl]amino]methyl]benzoic acid methyl ester Formula: C17H16BrNO3 MolecularWeight: 362.21784

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)CC2=CC=C(C=C2)Br

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)CC2=CC=C(C=C2)Br

InChI

InChI=1S/C17H16BrNO3/c1-22-17(21)14-6-2-13(3-7-14)11-19-16(20)10-12-4-8-15(18)9-5-12/h2-9H,10-11H2,1H3,(H,19,20)