1,3,3-trimethylindol-1-ium-5-carboxylic acid

Systemtic Name: 1,3,3-trimethylindol-1-ium-5-carboxylic acid Openeye Name: 1,3,3-trimethylindol-1-ium-5-carboxylic acid CAS Name: 1,3,3-trimethyl-5-indol-1-iumcarboxylic acid IUPAC Name: 1,3,3-trimethylindol-1-ium-5-carboxylic acid Traditional Name: 1,3,3-trimethylindol-1-ium-5-carboxylic acid Formula: C12H14NO2+ MolecularWeight: 204.24506

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=[N+](C2=C1C=C(C=C2)C(=O)O)C)C

Isomeric SMILES

CC1(C=[N+](C2=C1C=C(C=C2)C(=O)O)C)C

InChI

InChI=1S/C12H13NO2/c1-12(2)7-13(3)10-5-4-8(11(14)15)6-9(10)12/h4-7H,1-3H3/p+1