tert-butyl N-[4-[(4-chloranylisoquinolin-5-yl)amino]cyclohexyl]carbamate

Systemtic Name: tert-butyl N-[4-[(4-chloranylisoquinolin-5-yl)amino]cyclohexyl]carbamate Openeye Name: tert-butyl N-[4-[(4-chloro-5-isoquinolyl)amino]cyclohexyl]carbamate CAS Name: N-[4-[(4-chloro-5-isoquinolinyl)amino]cyclohexyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[(4-chloroisoquinolin-5-yl)amino]cyclohexyl]carbamate Traditional Name: N-[4-[(4-chloro-5-isoquinolyl)amino]cyclohexyl]carbamic acid tert-butyl ester Formula: C20H26ClN3O2 MolecularWeight: 375.89234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCC(CC1)NC2=CC=CC3=CN=CC(=C32)Cl

Isomeric SMILES

CC(C)(C)OC(=O)NC1CCC(CC1)NC2=CC=CC3=CN=CC(=C32)Cl

InChI

InChI=1S/C20H26ClN3O2/c1-20(2,3)26-19(25)24-15-9-7-14(8-10-15)23-17-6-4-5-13-11-22-12-16(21)18(13)17/h4-6,11-12,14-15,23H,7-10H2,1-3H3,(H,24,25)