2-(3-butanoylindol-1-yl)ethanoic acid

Systemtic Name: 2-(3-butanoylindol-1-yl)ethanoic acid Openeye Name: 2-(3-butanoylindol-1-yl)acetic acid CAS Name: 2-[3-(1-oxobutyl)-1-indolyl]acetic acid IUPAC Name: 2-(3-butanoylindol-1-yl)acetic acid Traditional Name: 2-(3-butyrylindol-1-yl)acetic acid Formula: C14H15NO3 MolecularWeight: 245.2738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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