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

Systemtic Name: tert-butyl N-[4-[(4-ethenylisoquinolin-5-yl)amino]cyclohexyl]carbamate Openeye Name: tert-butyl N-[4-[(4-vinyl-5-isoquinolyl)amino]cyclohexyl]carbamate CAS Name: N-[4-[(4-ethenyl-5-isoquinolinyl)amino]cyclohexyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[(4-ethenylisoquinolin-5-yl)amino]cyclohexyl]carbamate Traditional Name: N-[4-[(4-vinyl-5-isoquinolyl)amino]cyclohexyl]carbamic acid tert-butyl ester Formula: C22H29N3O2 MolecularWeight: 367.48456

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N3O2/c1-5-15-13-23-14-16-7-6-8-19(20(15)16)24-17-9-11-18(12-10-17)25-21(26)27-22(2,3)4/h5-8,13-14,17-18,24H,1,9-12H2,2-4H3,(H,25,26)