6-methoxy-3-(4-oxidanyl-4-oxidanylidene-butan-2-yl)-1H-indole-2-carboxylic acid

Systemtic Name: 6-methoxy-3-(4-oxidanyl-4-oxidanylidene-butan-2-yl)-1H-indole-2-carboxylic acid Openeye Name: 3-(3-hydroxy-1-methyl-3-oxo-propyl)-6-methoxy-1H-indole-2-carboxylic acid CAS Name: 3-(4-hydroxy-4-oxobutan-2-yl)-6-methoxy-1H-indole-2-carboxylic acid IUPAC Name: 3-(4-hydroxy-4-oxobutan-2-yl)-6-methoxy-1H-indole-2-carboxylic acid Traditional Name: 3-(3-hydroxy-3-keto-1-methyl-propyl)-6-methoxy-1H-indole-2-carboxylic acid Formula: C14H15NO5 MolecularWeight: 277.2726

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)C1=C(NC2=C1C=CC(=C2)OC)C(=O)O

Isomeric SMILES

CC(CC(=O)O)C1=C(NC2=C1C=CC(=C2)OC)C(=O)O

InChI

InChI=1S/C14H15NO5/c1-7(5-11(16)17)12-9-4-3-8(20-2)6-10(9)15-13(12)14(18)19/h3-4,6-7,15H,5H2,1-2H3,(H,16,17)(H,18,19)