2-[tert-butyl(dimethyl)silyl]-4-[(1-chloranylisoquinolin-4-yl)methyl]imidazole-1-sulfonic acid

Systemtic Name: 2-[tert-butyl(dimethyl)silyl]-4-[(1-chloranylisoquinolin-4-yl)methyl]imidazole-1-sulfonic acid Openeye Name: 2-[tert-butyl(dimethyl)silyl]-4-[(1-chloro-4-isoquinolyl)methyl]imidazole-1-sulfonic acid CAS Name: 2-[tert-butyl(dimethyl)silyl]-4-[(1-chloro-4-isoquinolinyl)methyl]-1-imidazolesulfonic acid IUPAC Name: 2-[tert-butyl(dimethyl)silyl]-4-[(1-chloroisoquinolin-4-yl)methyl]imidazole-1-sulfonic acid Traditional Name: 2-[tert-butyl(dimethyl)silyl]-4-[(1-chloro-4-isoquinolyl)methyl]imidazole-1-sulfonic acid Formula: C19H24ClN3O3SSi MolecularWeight: 438.01566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[Si](C)(C)C1=NC(=CN1S(=O)(=O)O)CC2=CN=C(C3=CC=CC=C32)Cl

Isomeric SMILES

CC(C)(C)[Si](C)(C)C1=NC(=CN1S(=O)(=O)O)CC2=CN=C(C3=CC=CC=C32)Cl

InChI

InChI=1S/C19H24ClN3O3SSi/c1-19(2,3)28(4,5)18-22-14(12-23(18)27(24,25)26)10-13-11-21-17(20)16-9-7-6-8-15(13)16/h6-9,11-12H,10H2,1-5H3,(H,24,25,26)