tert-butyl N-[[6-(1-azanyl-2-methyl-1-oxidanylidene-propan-2-yl)oxy-2-(2-methylpropyl)-1-oxidanylidene-4-phenyl-isoquinolin-3-yl]methyl]carbamate

Systemtic Name: tert-butyl N-[[6-(1-azanyl-2-methyl-1-oxidanylidene-propan-2-yl)oxy-2-(2-methylpropyl)-1-oxidanylidene-4-phenyl-isoquinolin-3-yl]methyl]carbamate Openeye Name: tert-butyl N-[[6-(2-amino-1,1-dimethyl-2-oxo-ethoxy)-2-isobutyl-1-oxo-4-phenyl-3-isoquinolyl]methyl]carbamate CAS Name: N-[[6-(1-amino-2-methyl-1-oxopropan-2-yl)oxy-2-(2-methylpropyl)-1-oxo-4-phenyl-3-isoquinolinyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[6-(1-amino-2-methyl-1-oxopropan-2-yl)oxy-2-(2-methylpropyl)-1-oxo-4-phenylisoquinolin-3-yl]methyl]carbamate Traditional Name: N-[[6-(2-amino-2-keto-1,1-dimethyl-ethoxy)-2-isobutyl-1-keto-4-phenyl-3-isoquinolyl]methyl]carbamic acid tert-butyl ester Formula: C29H37N3O5 MolecularWeight: 507.62118

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=C(C2=C(C1=O)C=CC(=C2)OC(C)(C)C(=O)N)C3=CC=CC=C3)CNC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)CN1C(=C(C2=C(C1=O)C=CC(=C2)OC(C)(C)C(=O)N)C3=CC=CC=C3)CNC(=O)OC(C)(C)C

InChI

InChI=1S/C29H37N3O5/c1-18(2)17-32-23(16-31-27(35)37-28(3,4)5)24(19-11-9-8-10-12-19)22-15-20(13-14-21(22)25(32)33)36-29(6,7)26(30)34/h8-15,18H,16-17H2,1-7H3,(H2,30,34)(H,31,35)