tert-butyl N-[4-(4-bromanylisoquinolin-5-yl)oxycyclohexyl]carbamate

Systemtic Name: tert-butyl N-[4-(4-bromanylisoquinolin-5-yl)oxycyclohexyl]carbamate Openeye Name: tert-butyl N-[4-[(4-bromo-5-isoquinolyl)oxy]cyclohexyl]carbamate CAS Name: N-[4-[(4-bromo-5-isoquinolinyl)oxy]cyclohexyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-(4-bromoisoquinolin-5-yl)oxycyclohexyl]carbamate Traditional Name: N-[4-[(4-bromo-5-isoquinolyl)oxy]cyclohexyl]carbamic acid tert-butyl ester Formula: C20H25BrN2O3 MolecularWeight: 421.3281

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCC(CC1)OC2=CC=CC3=CN=CC(=C32)Br

Isomeric SMILES

CC(C)(C)OC(=O)NC1CCC(CC1)OC2=CC=CC3=CN=CC(=C32)Br

InChI

InChI=1S/C20H25BrN2O3/c1-20(2,3)26-19(24)23-14-7-9-15(10-8-14)25-17-6-4-5-13-11-22-12-16(21)18(13)17/h4-6,11-12,14-15H,7-10H2,1-3H3,(H,23,24)