methyl 4-[[3-[(4-bromophenyl)carbonylamino]propanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[3-[(4-bromophenyl)carbonylamino]propanoylamino]methyl]benzoate Openeye Name: methyl 4-[[3-[(4-bromobenzoyl)amino]propanoylamino]methyl]benzoate CAS Name: 4-[[[3-[[(4-bromophenyl)-oxomethyl]amino]-1-oxopropyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-[(4-bromobenzoyl)amino]propanoylamino]methyl]benzoate Traditional Name: 4-[[3-[(4-bromobenzoyl)amino]propanoylamino]methyl]benzoic acid methyl ester Formula: C19H19BrN2O4 MolecularWeight: 419.26916

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19BrN2O4/c1-26-19(25)15-4-2-13(3-5-15)12-22-17(23)10-11-21-18(24)14-6-8-16(20)9-7-14/h2-9H,10-12H2,1H3,(H,21,24)(H,22,23)