1H-indol-3-yl 3,3-dimethyl-2-(4-methylpyridin-2-yl)carbonyl-butanoate

Systemtic Name: 1H-indol-3-yl 3,3-dimethyl-2-(4-methylpyridin-2-yl)carbonyl-butanoate Openeye Name: 1H-indol-3-yl 3,3-dimethyl-2-(4-methylpyridine-2-carbonyl)butanoate CAS Name: 3,3-dimethyl-2-[(4-methyl-2-pyridinyl)-oxomethyl]butanoic acid 1H-indol-3-yl ester IUPAC Name: 1H-indol-3-yl 3,3-dimethyl-2-(4-methylpyridine-2-carbonyl)butanoate Traditional Name: 3,3-dimethyl-2-(4-methylpicolinoyl)butyric acid 1H-indol-3-yl ester Formula: C21H22N2O3 MolecularWeight: 350.41098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)C(=O)C(C(=O)OC2=CNC3=CC=CC=C32)C(C)(C)C

Isomeric SMILES

CC1=CC(=NC=C1)C(=O)C(C(=O)OC2=CNC3=CC=CC=C32)C(C)(C)C

InChI

InChI=1S/C21H22N2O3/c1-13-9-10-22-16(11-13)19(24)18(21(2,3)4)20(25)26-17-12-23-15-8-6-5-7-14(15)17/h5-12,18,23H,1-4H3