(2-methyl-4-pyridin-3-yl-butan-2-yl) (2S)-1-(3,3-dimethyl-2-oxidanylidene-pentanoyl)azetidine-2-carboxylate

Systemtic Name: (2-methyl-4-pyridin-3-yl-butan-2-yl) (2S)-1-(3,3-dimethyl-2-oxidanylidene-pentanoyl)azetidine-2-carboxylate Openeye Name: [1,1-dimethyl-3-(3-pyridyl)propyl] (2S)-1-(3,3-dimethyl-2-oxo-pentanoyl)azetidine-2-carboxylate CAS Name: (2S)-1-(3,3-dimethyl-1,2-dioxopentyl)-2-azetidinecarboxylic acid [2-methyl-4-(3-pyridinyl)butan-2-yl] ester IUPAC Name: (2-methyl-4-pyridin-3-ylbutan-2-yl) (2S)-1-(3,3-dimethyl-2-oxopentanoyl)azetidine-2-carboxylate Traditional Name: (2S)-1-(2-keto-3,3-dimethyl-pentanoyl)azetidine-2-carboxylic acid [1,1-dimethyl-3-(3-pyridyl)propyl] ester Formula: C21H30N2O4 MolecularWeight: 374.4739

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)C(=O)N1CCC1C(=O)OC(C)(C)CCC2=CN=CC=C2

Isomeric SMILES

CCC(C)(C)C(=O)C(=O)N1CC[C@H]1C(=O)OC(C)(C)CCC2=CN=CC=C2

InChI

InChI=1S/C21H30N2O4/c1-6-20(2,3)17(24)18(25)23-13-10-16(23)19(26)27-21(4,5)11-9-15-8-7-12-22-14-15/h7-8,12,14,16H,6,9-11,13H2,1-5H3/t16-/m0/s1