2-[3-(2-methylpropanoyl)indol-1-yl]ethanoic acid

Systemtic Name: 2-[3-(2-methylpropanoyl)indol-1-yl]ethanoic acid Openeye Name: 2-[3-(2-methylpropanoyl)indol-1-yl]acetic acid CAS Name: 2-[3-(2-methyl-1-oxopropyl)-1-indolyl]acetic acid IUPAC Name: 2-[3-(2-methylpropanoyl)indol-1-yl]acetic acid Traditional Name: 2-(3-isobutyrylindol-1-yl)acetic acid Formula: C14H15NO3 MolecularWeight: 245.2738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C1=CN(C2=CC=CC=C21)CC(=O)O

Isomeric SMILES

CC(C)C(=O)C1=CN(C2=CC=CC=C21)CC(=O)O

InChI

InChI=1S/C14H15NO3/c1-9(2)14(18)11-7-15(8-13(16)17)12-6-4-3-5-10(11)12/h3-7,9H,8H2,1-2H3,(H,16,17)