methyl 2-[3-[3,4-bis(chloranyl)phenoxy]propylamino]-5-bromanyl-benzoate

Systemtic Name: methyl 2-[3-[3,4-bis(chloranyl)phenoxy]propylamino]-5-bromanyl-benzoate Openeye Name: methyl 5-bromo-2-[3-(3,4-dichlorophenoxy)propylamino]benzoate CAS Name: 5-bromo-2-[3-(3,4-dichlorophenoxy)propylamino]benzoic acid methyl ester IUPAC Name: methyl 5-bromo-2-[3-(3,4-dichlorophenoxy)propylamino]benzoate Traditional Name: 5-bromo-2-[3-(3,4-dichlorophenoxy)propylamino]benzoic acid methyl ester Formula: C17H16BrCl2NO3 MolecularWeight: 433.12384

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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