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

Systemtic Name: methyl 2-[3-[3,5-bis(chloranyl)phenoxy]propylamino]-3-bromanyl-5-methyl-benzoate Openeye Name: methyl 3-bromo-2-[3-(3,5-dichlorophenoxy)propylamino]-5-methyl-benzoate CAS Name: 3-bromo-2-[3-(3,5-dichlorophenoxy)propylamino]-5-methylbenzoic acid methyl ester IUPAC Name: methyl 3-bromo-2-[3-(3,5-dichlorophenoxy)propylamino]-5-methylbenzoate Traditional Name: 3-bromo-2-[3-(3,5-dichlorophenoxy)propylamino]-5-methyl-benzoic acid methyl ester Formula: C18H18BrCl2NO3 MolecularWeight: 447.15042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C(=O)OC)NCCCOC2=CC(=CC(=C2)Cl)Cl)Br

Isomeric SMILES

CC1=CC(=C(C(=C1)C(=O)OC)NCCCOC2=CC(=CC(=C2)Cl)Cl)Br

InChI

InChI=1S/C18H18BrCl2NO3/c1-11-6-15(18(23)24-2)17(16(19)7-11)22-4-3-5-25-14-9-12(20)8-13(21)10-14/h6-10,22H,3-5H2,1-2H3