3-(3-tert-butylpyridin-2-yl)-2-(6-chloranyl-1H-indol-3-yl)-3-oxidanylidene-propanoic acid

Systemtic Name: 3-(3-tert-butylpyridin-2-yl)-2-(6-chloranyl-1H-indol-3-yl)-3-oxidanylidene-propanoic acid Openeye Name: 3-(3-tert-butyl-2-pyridyl)-2-(6-chloro-1H-indol-3-yl)-3-oxo-propanoic acid CAS Name: 3-(3-tert-butyl-2-pyridinyl)-2-(6-chloro-1H-indol-3-yl)-3-oxopropanoic acid IUPAC Name: 3-(3-tert-butylpyridin-2-yl)-2-(6-chloro-1H-indol-3-yl)-3-oxopropanoic acid Traditional Name: 3-(3-tert-butyl-2-pyridyl)-2-(6-chloro-1H-indol-3-yl)-3-keto-propionic acid Formula: C20H19ClN2O3 MolecularWeight: 370.82946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(N=CC=C1)C(=O)C(C2=CNC3=C2C=CC(=C3)Cl)C(=O)O

Isomeric SMILES

CC(C)(C)C1=C(N=CC=C1)C(=O)C(C2=CNC3=C2C=CC(=C3)Cl)C(=O)O

InChI

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