3-bromanyl-2-[2-(4-chloranyl-3,5-dimethyl-phenoxy)ethylamino]-5-methyl-benzoic acid

Systemtic Name: 3-bromanyl-2-[2-(4-chloranyl-3,5-dimethyl-phenoxy)ethylamino]-5-methyl-benzoic acid Openeye Name: 3-bromo-2-[2-(4-chloro-3,5-dimethyl-phenoxy)ethylamino]-5-methyl-benzoic acid CAS Name: 3-bromo-2-[2-(4-chloro-3,5-dimethylphenoxy)ethylamino]-5-methylbenzoic acid IUPAC Name: 3-bromo-2-[2-(4-chloro-3,5-dimethylphenoxy)ethylamino]-5-methylbenzoic acid Traditional Name: 3-bromo-2-[2-(4-chloro-3,5-dimethyl-phenoxy)ethylamino]-5-methyl-benzoic acid Formula: C18H19BrClNO3 MolecularWeight: 412.70536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C(=O)O)NCCOC2=CC(=C(C(=C2)C)Cl)C)Br

Isomeric SMILES

CC1=CC(=C(C(=C1)C(=O)O)NCCOC2=CC(=C(C(=C2)C)Cl)C)Br

InChI

InChI=1S/C18H19BrClNO3/c1-10-6-14(18(22)23)17(15(19)7-10)21-4-5-24-13-8-11(2)16(20)12(3)9-13/h6-9,21H,4-5H2,1-3H3,(H,22,23)