methyl 5-bromanyl-2-(3-phenoxypropylamino)benzoate

Systemtic Name: methyl 5-bromanyl-2-(3-phenoxypropylamino)benzoate Openeye Name: methyl 5-bromo-2-(3-phenoxypropylamino)benzoate CAS Name: 5-bromo-2-(3-phenoxypropylamino)benzoic acid methyl ester IUPAC Name: methyl 5-bromo-2-(3-phenoxypropylamino)benzoate Traditional Name: 5-bromo-2-(3-phenoxypropylamino)benzoic acid methyl ester Formula: C17H18BrNO3 MolecularWeight: 364.23372

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)Br)NCCCOC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)Br)NCCCOC2=CC=CC=C2

InChI

InChI=1S/C17H18BrNO3/c1-21-17(20)15-12-13(18)8-9-16(15)19-10-5-11-22-14-6-3-2-4-7-14/h2-4,6-9,12,19H,5,10-11H2,1H3