tert-butyl N-[1-oxidanylidene-3-(3,4,5-trimethoxyphenyl)isoquinolin-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-oxidanylidene-3-(3,4,5-trimethoxyphenyl)isoquinolin-2-yl]carbamate Openeye Name: tert-butyl N-[1-oxo-3-(3,4,5-trimethoxyphenyl)-2-isoquinolyl]carbamate CAS Name: N-[1-oxo-3-(3,4,5-trimethoxyphenyl)-2-isoquinolinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-oxo-3-(3,4,5-trimethoxyphenyl)isoquinolin-2-yl]carbamate Traditional Name: N-[1-keto-3-(3,4,5-trimethoxyphenyl)-2-isoquinolyl]carbamic acid tert-butyl ester Formula: C23H26N2O6 MolecularWeight: 426.46234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NN1C(=CC2=CC=CC=C2C1=O)C3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CC(C)(C)OC(=O)NN1C(=CC2=CC=CC=C2C1=O)C3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C23H26N2O6/c1-23(2,3)31-22(27)24-25-17(11-14-9-7-8-10-16(14)21(25)26)15-12-18(28-4)20(30-6)19(13-15)29-5/h7-13H,1-6H3,(H,24,27)