2-[3-[3,5-bis(chloranyl)phenoxy]propylamino]-5-bromanyl-benzoic acid

Systemtic Name: 2-[3-[3,5-bis(chloranyl)phenoxy]propylamino]-5-bromanyl-benzoic acid Openeye Name: 5-bromo-2-[3-(3,5-dichlorophenoxy)propylamino]benzoic acid CAS Name: 5-bromo-2-[3-(3,5-dichlorophenoxy)propylamino]benzoic acid IUPAC Name: 5-bromo-2-[3-(3,5-dichlorophenoxy)propylamino]benzoic acid Traditional Name: 5-bromo-2-[3-(3,5-dichlorophenoxy)propylamino]benzoic acid Formula: C16H14BrCl2NO3 MolecularWeight: 419.09726

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)C(=O)O)NCCCOC2=CC(=CC(=C2)Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1Br)C(=O)O)NCCCOC2=CC(=CC(=C2)Cl)Cl

InChI

InChI=1S/C16H14BrCl2NO3/c17-10-2-3-15(14(6-10)16(21)22)20-4-1-5-23-13-8-11(18)7-12(19)9-13/h2-3,6-9,20H,1,4-5H2,(H,21,22)