2-ethyl-1-methyl-6-oxidanyl-indole-3-carboxylic acid

Systemtic Name: 2-ethyl-1-methyl-6-oxidanyl-indole-3-carboxylic acid Openeye Name: 2-ethyl-6-hydroxy-1-methyl-indole-3-carboxylic acid CAS Name: 2-ethyl-6-hydroxy-1-methyl-3-indolecarboxylic acid IUPAC Name: 2-ethyl-6-hydroxy-1-methylindole-3-carboxylic acid Traditional Name: 2-ethyl-6-hydroxy-1-methyl-indole-3-carboxylic acid Formula: C12H13NO3 MolecularWeight: 219.23652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(N1C)C=C(C=C2)O)C(=O)O

Isomeric SMILES

CCC1=C(C2=C(N1C)C=C(C=C2)O)C(=O)O

InChI

InChI=1S/C12H13NO3/c1-3-9-11(12(15)16)8-5-4-7(14)6-10(8)13(9)2/h4-6,14H,3H2,1-2H3,(H,15,16)