[4-(2-phenylpropan-2-yl)phenyl] 5-chloranyl-1-methyl-imidazole-4-sulfonate

Systemtic Name: [4-(2-phenylpropan-2-yl)phenyl] 5-chloranyl-1-methyl-imidazole-4-sulfonate Openeye Name: [4-(1-methyl-1-phenyl-ethyl)phenyl] 5-chloro-1-methyl-imidazole-4-sulfonate CAS Name: 5-chloro-1-methyl-4-imidazolesulfonic acid [4-(2-phenylpropan-2-yl)phenyl] ester IUPAC Name: [4-(2-phenylpropan-2-yl)phenyl] 5-chloro-1-methylimidazole-4-sulfonate Traditional Name: 5-chloro-1-methyl-imidazole-4-sulfonic acid (4-cumylphenyl) ester Formula: C19H19ClN2O3S MolecularWeight: 390.88376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OS(=O)(=O)C3=C(N(C=N3)C)Cl

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OS(=O)(=O)C3=C(N(C=N3)C)Cl

InChI

InChI=1S/C19H19ClN2O3S/c1-19(2,14-7-5-4-6-8-14)15-9-11-16(12-10-15)25-26(23,24)18-17(20)22(3)13-21-18/h4-13H,1-3H3