3-(3-bromanyl-5-methoxy-4-propan-2-yloxy-phenyl)propanoic acid

Systemtic Name: 3-(3-bromanyl-5-methoxy-4-propan-2-yloxy-phenyl)propanoic acid Openeye Name: 3-(3-bromo-4-isopropoxy-5-methoxy-phenyl)propanoic acid CAS Name: 3-(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)propanoic acid IUPAC Name: 3-(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)propanoic acid Traditional Name: 3-(3-bromo-4-isopropoxy-5-methoxy-phenyl)propionic acid Formula: C13H17BrO4 MolecularWeight: 317.17568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1Br)CCC(=O)O)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1Br)CCC(=O)O)OC

InChI

InChI=1S/C13H17BrO4/c1-8(2)18-13-10(14)6-9(4-5-12(15)16)7-11(13)17-3/h6-8H,4-5H2,1-3H3,(H,15,16)