2-(5-bromanylpyridin-2-yl)-1-(carboxymethyl)-3-cyclohexyl-indole-6-carboxylic acid

Systemtic Name: 2-(5-bromanylpyridin-2-yl)-1-(carboxymethyl)-3-cyclohexyl-indole-6-carboxylic acid Openeye Name: 2-(5-bromo-2-pyridyl)-1-(carboxymethyl)-3-cyclohexyl-indole-6-carboxylic acid CAS Name: 2-(5-bromo-2-pyridinyl)-1-(carboxymethyl)-3-cyclohexyl-6-indolecarboxylic acid IUPAC Name: 2-(5-bromopyridin-2-yl)-1-(carboxymethyl)-3-cyclohexylindole-6-carboxylic acid Traditional Name: 2-(5-bromo-2-pyridyl)-1-(carboxymethyl)-3-cyclohexyl-indole-6-carboxylic acid Formula: C22H21BrN2O4 MolecularWeight: 457.31714

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(N(C3=C2C=CC(=C3)C(=O)O)CC(=O)O)C4=NC=C(C=C4)Br

Isomeric SMILES

C1CCC(CC1)C2=C(N(C3=C2C=CC(=C3)C(=O)O)CC(=O)O)C4=NC=C(C=C4)Br

InChI

InChI=1S/C22H21BrN2O4/c23-15-7-9-17(24-11-15)21-20(13-4-2-1-3-5-13)16-8-6-14(22(28)29)10-18(16)25(21)12-19(26)27/h6-11,13H,1-5,12H2,(H,26,27)(H,28,29)