3-[4-[2-(2,5-diethylpyrrol-1-yl)ethoxy]phenyl]-2-ethoxy-propanoic acid

Systemtic Name: 3-[4-[2-(2,5-diethylpyrrol-1-yl)ethoxy]phenyl]-2-ethoxy-propanoic acid Openeye Name: 3-[4-[2-(2,5-diethylpyrrol-1-yl)ethoxy]phenyl]-2-ethoxy-propanoic acid CAS Name: 3-[4-[2-(2,5-diethyl-1-pyrrolyl)ethoxy]phenyl]-2-ethoxypropanoic acid IUPAC Name: 3-[4-[2-(2,5-diethylpyrrol-1-yl)ethoxy]phenyl]-2-ethoxypropanoic acid Traditional Name: 3-[4-[2-(2,5-diethylpyrrol-1-yl)ethoxy]phenyl]-2-ethoxy-propionic acid Formula: C21H29NO4 MolecularWeight: 359.45926

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(N1CCOC2=CC=C(C=C2)CC(C(=O)O)OCC)CC

Isomeric SMILES

CCC1=CC=C(N1CCOC2=CC=C(C=C2)CC(C(=O)O)OCC)CC

InChI

InChI=1S/C21H29NO4/c1-4-17-9-10-18(5-2)22(17)13-14-26-19-11-7-16(8-12-19)15-20(21(23)24)25-6-3/h7-12,20H,4-6,13-15H2,1-3H3,(H,23,24)