2-[2-(4-tert-butylpyridin-2-yl)carbonyl-5-chloranyl-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[2-(4-tert-butylpyridin-2-yl)carbonyl-5-chloranyl-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(4-tert-butylpyridine-2-carbonyl)-5-chloro-1H-indol-3-yl]acetic acid CAS Name: 2-[2-[(4-tert-butyl-2-pyridinyl)-oxomethyl]-5-chloro-1H-indol-3-yl]acetic acid IUPAC Name: 2-[2-(4-tert-butylpyridine-2-carbonyl)-5-chloro-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(4-tert-butylpicolinoyl)-5-chloro-1H-indol-3-yl]acetic acid Formula: C20H19ClN2O3 MolecularWeight: 370.82946

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NC=C1)C(=O)C2=C(C3=C(N2)C=CC(=C3)Cl)CC(=O)O

Isomeric SMILES

CC(C)(C)C1=CC(=NC=C1)C(=O)C2=C(C3=C(N2)C=CC(=C3)Cl)CC(=O)O

InChI

InChI=1S/C20H19ClN2O3/c1-20(2,3)11-6-7-22-16(8-11)19(26)18-14(10-17(24)25)13-9-12(21)4-5-15(13)23-18/h4-9,23H,10H2,1-3H3,(H,24,25)