tert-butyl 2-[[4-azanyl-2-(ethoxymethyl)-7-pyridin-3-yl-imidazo[4,5-c]quinolin-1-yl]methyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 2-[[4-azanyl-2-(ethoxymethyl)-7-pyridin-3-yl-imidazo[4,5-c]quinolin-1-yl]methyl]piperidine-1-carboxylate Openeye Name: tert-butyl 2-[[4-amino-2-(ethoxymethyl)-7-(3-pyridyl)imidazo[4,5-c]quinolin-1-yl]methyl]piperidine-1-carboxylate CAS Name: 2-[[4-amino-2-(ethoxymethyl)-7-(3-pyridinyl)-1-imidazo[4,5-c]quinolinyl]methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[4-amino-2-(ethoxymethyl)-7-pyridin-3-ylimidazo[4,5-c]quinolin-1-yl]methyl]piperidine-1-carboxylate Traditional Name: 2-[[4-amino-2-(ethoxymethyl)-7-(3-pyridyl)imidazo[4,5-c]quinolin-1-yl]methyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C29H36N6O3 MolecularWeight: 516.63454

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=NC2=C(N1CC3CCCCN3C(=O)OC(C)(C)C)C4=C(C=C(C=C4)C5=CN=CC=C5)N=C2N

Isomeric SMILES

CCOCC1=NC2=C(N1CC3CCCCN3C(=O)OC(C)(C)C)C4=C(C=C(C=C4)C5=CN=CC=C5)N=C2N

InChI

InChI=1S/C29H36N6O3/c1-5-37-18-24-33-25-26(35(24)17-21-10-6-7-14-34(21)28(36)38-29(2,3)4)22-12-11-19(15-23(22)32-27(25)30)20-9-8-13-31-16-20/h8-9,11-13,15-16,21H,5-7,10,14,17-18H2,1-4H3,(H2,30,32)