3-methoxy-4-(2-oxidanylpropan-2-yl)-1H-indole-2-carboxylic acid

Systemtic Name: 3-methoxy-4-(2-oxidanylpropan-2-yl)-1H-indole-2-carboxylic acid Openeye Name: 4-(1-hydroxy-1-methyl-ethyl)-3-methoxy-1H-indole-2-carboxylic acid CAS Name: 4-(2-hydroxypropan-2-yl)-3-methoxy-1H-indole-2-carboxylic acid IUPAC Name: 4-(2-hydroxypropan-2-yl)-3-methoxy-1H-indole-2-carboxylic acid Traditional Name: 4-(1-hydroxy-1-methyl-ethyl)-3-methoxy-1H-indole-2-carboxylic acid Formula: C13H15NO4 MolecularWeight: 249.2625

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=C2C(=CC=C1)NC(=C2OC)C(=O)O)O

Isomeric SMILES

CC(C)(C1=C2C(=CC=C1)NC(=C2OC)C(=O)O)O

InChI

InChI=1S/C13H15NO4/c1-13(2,17)7-5-4-6-8-9(7)11(18-3)10(14-8)12(15)16/h4-6,14,17H,1-3H3,(H,15,16)