3-[3-bromanyl-5-ethoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]propanoic acid

Systemtic Name: 3-[3-bromanyl-5-ethoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]propanoic acid Openeye Name: 3-[3-bromo-5-ethoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]propanoic acid CAS Name: 3-[3-bromo-5-ethoxy-4-[2-(1-pyrrolidinyl)ethoxy]phenyl]propanoic acid IUPAC Name: 3-[3-bromo-5-ethoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]propanoic acid Traditional Name: 3-[3-bromo-5-ethoxy-4-(2-pyrrolidinoethoxy)phenyl]propionic acid Formula: C17H24BrNO4 MolecularWeight: 386.28076

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)CCC(=O)O)Br)OCCN2CCCC2

Isomeric SMILES

CCOC1=C(C(=CC(=C1)CCC(=O)O)Br)OCCN2CCCC2

InChI

InChI=1S/C17H24BrNO4/c1-2-22-15-12-13(5-6-16(20)21)11-14(18)17(15)23-10-9-19-7-3-4-8-19/h11-12H,2-10H2,1H3,(H,20,21)