methyl 2-[3-[3,5-bis(chloranyl)phenoxy]propylamino]-5-bromanyl-benzoate

Systemtic Name: methyl 2-[3-[3,5-bis(chloranyl)phenoxy]propylamino]-5-bromanyl-benzoate Openeye Name: methyl 5-bromo-2-[3-(3,5-dichlorophenoxy)propylamino]benzoate CAS Name: 5-bromo-2-[3-(3,5-dichlorophenoxy)propylamino]benzoic acid methyl ester IUPAC Name: methyl 5-bromo-2-[3-(3,5-dichlorophenoxy)propylamino]benzoate Traditional Name: 5-bromo-2-[3-(3,5-dichlorophenoxy)propylamino]benzoic acid methyl ester Formula: C17H16BrCl2NO3 MolecularWeight: 433.12384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16BrCl2NO3/c1-23-17(22)15-7-11(18)3-4-16(15)21-5-2-6-24-14-9-12(19)8-13(20)10-14/h3-4,7-10,21H,2,5-6H2,1H3