3-bromanyl-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-methoxy-benzoic acid

Systemtic Name: 3-bromanyl-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-methoxy-benzoic acid Openeye Name: 3-bromo-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-methoxy-benzoic acid CAS Name: 3-bromo-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-methoxybenzoic acid IUPAC Name: 3-bromo-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-methoxybenzoic acid Traditional Name: 3-bromo-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-methoxy-benzoic acid Formula: C18H19BrO5 MolecularWeight: 395.24446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCCOC2=C(C=C(C=C2Br)C(=O)O)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)OCCOC2=C(C=C(C=C2Br)C(=O)O)OC)C

InChI

InChI=1S/C18H19BrO5/c1-11-4-5-14(8-12(11)2)23-6-7-24-17-15(19)9-13(18(20)21)10-16(17)22-3/h4-5,8-10H,6-7H2,1-3H3,(H,20,21)