methyl 5-bromanyl-2-(4-phenoxybutanoylamino)benzoate

Systemtic Name: methyl 5-bromanyl-2-(4-phenoxybutanoylamino)benzoate Openeye Name: methyl 5-bromo-2-(4-phenoxybutanoylamino)benzoate CAS Name: 5-bromo-2-[(1-oxo-4-phenoxybutyl)amino]benzoic acid methyl ester IUPAC Name: methyl 5-bromo-2-(4-phenoxybutanoylamino)benzoate Traditional Name: 5-bromo-2-(4-phenoxybutanoylamino)benzoic acid methyl ester Formula: C18H18BrNO4 MolecularWeight: 392.24382

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)Br)NC(=O)CCCOC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)Br)NC(=O)CCCOC2=CC=CC=C2

InChI

InChI=1S/C18H18BrNO4/c1-23-18(22)15-12-13(19)9-10-16(15)20-17(21)8-5-11-24-14-6-3-2-4-7-14/h2-4,6-7,9-10,12H,5,8,11H2,1H3,(H,20,21)