3-bromanyl-5-chloranyl-2-[3-(dimethylamino)propoxy]benzoic acid

Systemtic Name: 3-bromanyl-5-chloranyl-2-[3-(dimethylamino)propoxy]benzoic acid Openeye Name: 3-bromo-5-chloro-2-[3-(dimethylamino)propoxy]benzoic acid CAS Name: 3-bromo-5-chloro-2-[3-(dimethylamino)propoxy]benzoic acid IUPAC Name: 3-bromo-5-chloro-2-[3-(dimethylamino)propoxy]benzoic acid Traditional Name: 3-bromo-5-chloro-2-[3-(dimethylamino)propoxy]benzoic acid Formula: C12H15BrClNO3 MolecularWeight: 336.6094

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCOC1=C(C=C(C=C1C(=O)O)Cl)Br

Isomeric SMILES

CN(C)CCCOC1=C(C=C(C=C1C(=O)O)Cl)Br

InChI

InChI=1S/C12H15BrClNO3/c1-15(2)4-3-5-18-11-9(12(16)17)6-8(14)7-10(11)13/h6-7H,3-5H2,1-2H3,(H,16,17)