3-(4-tert-butylpyridin-2-yl)-2-(5-chloranyl-1H-indol-3-yl)-3-oxidanylidene-propanoic acid

Systemtic Name: 3-(4-tert-butylpyridin-2-yl)-2-(5-chloranyl-1H-indol-3-yl)-3-oxidanylidene-propanoic acid Openeye Name: 3-(4-tert-butyl-2-pyridyl)-2-(5-chloro-1H-indol-3-yl)-3-oxo-propanoic acid CAS Name: 3-(4-tert-butyl-2-pyridinyl)-2-(5-chloro-1H-indol-3-yl)-3-oxopropanoic acid IUPAC Name: 3-(4-tert-butylpyridin-2-yl)-2-(5-chloro-1H-indol-3-yl)-3-oxopropanoic acid Traditional Name: 3-(4-tert-butyl-2-pyridyl)-2-(5-chloro-1H-indol-3-yl)-3-keto-propionic 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)C(C2=CNC3=C2C=C(C=C3)Cl)C(=O)O

Isomeric SMILES

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

InChI

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