tert-butyl [2-(2-oxidanylidenepropanoyl)-3,4-dihydro-1H-isoquinolin-3-yl] carbonate

Systemtic Name: tert-butyl [2-(2-oxidanylidenepropanoyl)-3,4-dihydro-1H-isoquinolin-3-yl] carbonate Openeye Name: tert-butyl [2-(2-oxopropanoyl)-3,4-dihydro-1H-isoquinolin-3-yl] carbonate CAS Name: carbonic acid tert-butyl [2-(1,2-dioxopropyl)-3,4-dihydro-1H-isoquinolin-3-yl] ester IUPAC Name: tert-butyl [2-(2-oxopropanoyl)-3,4-dihydro-1H-isoquinolin-3-yl] carbonate Traditional Name: carbonic acid tert-butyl (2-pyruvoyl-3,4-dihydro-1H-isoquinolin-3-yl) ester Formula: C17H21NO5 MolecularWeight: 319.35234

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=O)N1CC2=CC=CC=C2CC1OC(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)C(=O)N1CC2=CC=CC=C2CC1OC(=O)OC(C)(C)C

InChI

InChI=1S/C17H21NO5/c1-11(19)15(20)18-10-13-8-6-5-7-12(13)9-14(18)22-16(21)23-17(2,3)4/h5-8,14H,9-10H2,1-4H3