3-(2-methylpropanoyl)-1H-indole-6-carboxylate

Systemtic Name: 3-(2-methylpropanoyl)-1H-indole-6-carboxylate Openeye Name: 3-(2-methylpropanoyl)-1H-indole-6-carboxylate CAS Name: 3-(2-methyl-1-oxopropyl)-1H-indole-6-carboxylate IUPAC Name: 3-(2-methylpropanoyl)-1H-indole-6-carboxylate Traditional Name: 3-isobutyryl-1H-indole-6-carboxylate Formula: C13H12NO3- MolecularWeight: 230.23928

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C1=CNC2=C1C=CC(=C2)C(=O)[O-]

Isomeric SMILES

CC(C)C(=O)C1=CNC2=C1C=CC(=C2)C(=O)[O-]

InChI

InChI=1S/C13H13NO3/c1-7(2)12(15)10-6-14-11-5-8(13(16)17)3-4-9(10)11/h3-7,14H,1-2H3,(H,16,17)/p-1