3-(2-carboxyethyl)-4-(trifluoromethyl)-1H-indole-2-carboxylic acid

Systemtic Name: 3-(2-carboxyethyl)-4-(trifluoromethyl)-1H-indole-2-carboxylic acid Openeye Name: 3-(2-carboxyethyl)-4-(trifluoromethyl)-1H-indole-2-carboxylic acid CAS Name: 3-(2-carboxyethyl)-4-(trifluoromethyl)-1H-indole-2-carboxylic acid IUPAC Name: 3-(2-carboxyethyl)-4-(trifluoromethyl)-1H-indole-2-carboxylic acid Traditional Name: 3-(2-carboxyethyl)-4-(trifluoromethyl)-1H-indole-2-carboxylic acid Formula: C13H10F3NO4 MolecularWeight: 301.21801

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)NC(=C2CCC(=O)O)C(=O)O)C(F)(F)F

Isomeric SMILES

C1=CC(=C2C(=C1)NC(=C2CCC(=O)O)C(=O)O)C(F)(F)F

InChI

InChI=1S/C13H10F3NO4/c14-13(15,16)7-2-1-3-8-10(7)6(4-5-9(18)19)11(17-8)12(20)21/h1-3,17H,4-5H2,(H,18,19)(H,20,21)