tert-butyl 4-[(4-azanyl-7-bromanyl-2-ethyl-imidazo[4,5-c]quinolin-1-yl)methyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(4-azanyl-7-bromanyl-2-ethyl-imidazo[4,5-c]quinolin-1-yl)methyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(4-amino-7-bromo-2-ethyl-imidazo[4,5-c]quinolin-1-yl)methyl]piperidine-1-carboxylate CAS Name: 4-[(4-amino-7-bromo-2-ethyl-1-imidazo[4,5-c]quinolinyl)methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(4-amino-7-bromo-2-ethylimidazo[4,5-c]quinolin-1-yl)methyl]piperidine-1-carboxylate Traditional Name: 4-[(4-amino-7-bromo-2-ethyl-imidazo[4,5-c]quinolin-1-yl)methyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C23H30BrN5O2 MolecularWeight: 488.4206

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1CC3CCN(CC3)C(=O)OC(C)(C)C)C4=C(C=C(C=C4)Br)N=C2N

Isomeric SMILES

CCC1=NC2=C(N1CC3CCN(CC3)C(=O)OC(C)(C)C)C4=C(C=C(C=C4)Br)N=C2N

InChI

InChI=1S/C23H30BrN5O2/c1-5-18-27-19-20(16-7-6-15(24)12-17(16)26-21(19)25)29(18)13-14-8-10-28(11-9-14)22(30)31-23(2,3)4/h6-7,12,14H,5,8-11,13H2,1-4H3,(H2,25,26)