2-[2-(5-bromanyl-2-ethoxy-phenyl)-7-ethyl-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[2-(5-bromanyl-2-ethoxy-phenyl)-7-ethyl-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(5-bromo-2-ethoxy-phenyl)-7-ethyl-1H-indol-3-yl]acetic acid CAS Name: 2-[2-(5-bromo-2-ethoxyphenyl)-7-ethyl-1H-indol-3-yl]acetic acid IUPAC Name: 2-[2-(5-bromo-2-ethoxyphenyl)-7-ethyl-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(5-bromo-2-ethoxy-phenyl)-7-ethyl-1H-indol-3-yl]acetic acid Formula: C20H20BrNO3 MolecularWeight: 402.2817

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC(=C2CC(=O)O)C3=C(C=CC(=C3)Br)OCC

Isomeric SMILES

CCC1=CC=CC2=C1NC(=C2CC(=O)O)C3=C(C=CC(=C3)Br)OCC

InChI

InChI=1S/C20H20BrNO3/c1-3-12-6-5-7-14-15(11-18(23)24)20(22-19(12)14)16-10-13(21)8-9-17(16)25-4-2/h5-10,22H,3-4,11H2,1-2H3,(H,23,24)