tert-butyl N-[[2-(2,2-dimethylpropyl)-4-(2-methoxyethoxy)-1-oxidanylidene-isoquinolin-3-yl]methyl]carbamate

Systemtic Name: tert-butyl N-[[2-(2,2-dimethylpropyl)-4-(2-methoxyethoxy)-1-oxidanylidene-isoquinolin-3-yl]methyl]carbamate Openeye Name: tert-butyl N-[[2-(2,2-dimethylpropyl)-4-(2-methoxyethoxy)-1-oxo-3-isoquinolyl]methyl]carbamate CAS Name: N-[[2-(2,2-dimethylpropyl)-4-(2-methoxyethoxy)-1-oxo-3-isoquinolinyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[2-(2,2-dimethylpropyl)-4-(2-methoxyethoxy)-1-oxoisoquinolin-3-yl]methyl]carbamate Traditional Name: N-[[1-keto-4-(2-methoxyethoxy)-2-neopentyl-3-isoquinolyl]methyl]carbamic acid tert-butyl ester Formula: C23H34N2O5 MolecularWeight: 418.52646

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CN1C(=C(C2=CC=CC=C2C1=O)OCCOC)CNC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)CN1C(=C(C2=CC=CC=C2C1=O)OCCOC)CNC(=O)OC(C)(C)C

InChI

InChI=1S/C23H34N2O5/c1-22(2,3)15-25-18(14-24-21(27)30-23(4,5)6)19(29-13-12-28-7)16-10-8-9-11-17(16)20(25)26/h8-11H,12-15H2,1-7H3,(H,24,27)