2-(5-bromanyl-3-ethyl-2-methyl-indol-3-yl)ethanoic acid

Systemtic Name: 2-(5-bromanyl-3-ethyl-2-methyl-indol-3-yl)ethanoic acid Openeye Name: 2-(5-bromo-3-ethyl-2-methyl-indol-3-yl)acetic acid CAS Name: 2-(5-bromo-3-ethyl-2-methyl-3-indolyl)acetic acid IUPAC Name: 2-(5-bromo-3-ethyl-2-methylindol-3-yl)acetic acid Traditional Name: 2-(5-bromo-3-ethyl-2-methyl-indol-3-yl)acetic acid Formula: C13H14BrNO2 MolecularWeight: 296.15976

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=NC2=C1C=C(C=C2)Br)C)CC(=O)O

Isomeric SMILES

CCC1(C(=NC2=C1C=C(C=C2)Br)C)CC(=O)O

InChI

InChI=1S/C13H14BrNO2/c1-3-13(7-12(16)17)8(2)15-11-5-4-9(14)6-10(11)13/h4-6H,3,7H2,1-2H3,(H,16,17)