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

Systemtic Name: 2-[2-(5-bromanyl-2-methoxy-phenyl)-5-ethoxy-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(5-bromo-2-methoxy-phenyl)-5-ethoxy-1H-indol-3-yl]acetic acid CAS Name: 2-[2-(5-bromo-2-methoxyphenyl)-5-ethoxy-1H-indol-3-yl]acetic acid IUPAC Name: 2-[2-(5-bromo-2-methoxyphenyl)-5-ethoxy-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(5-bromo-2-methoxy-phenyl)-5-ethoxy-1H-indol-3-yl]acetic acid Formula: C19H18BrNO4 MolecularWeight: 404.25452

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)NC(=C2CC(=O)O)C3=C(C=CC(=C3)Br)OC

Isomeric SMILES

CCOC1=CC2=C(C=C1)NC(=C2CC(=O)O)C3=C(C=CC(=C3)Br)OC

InChI

InChI=1S/C19H18BrNO4/c1-3-25-12-5-6-16-13(9-12)14(10-18(22)23)19(21-16)15-8-11(20)4-7-17(15)24-2/h4-9,21H,3,10H2,1-2H3,(H,22,23)