ethyl 2-(bromomethyl)-5-(4-methylphenyl)sulfonyloxy-1-phenyl-indole-3-carboxylate

Systemtic Name: ethyl 2-(bromomethyl)-5-(4-methylphenyl)sulfonyloxy-1-phenyl-indole-3-carboxylate Openeye Name: ethyl 2-(bromomethyl)-1-phenyl-5-(p-tolylsulfonyloxy)indole-3-carboxylate CAS Name: 2-(bromomethyl)-5-(4-methylphenyl)sulfonyloxy-1-phenyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(bromomethyl)-5-(4-methylphenyl)sulfonyloxy-1-phenylindole-3-carboxylate Traditional Name: 2-(bromomethyl)-1-phenyl-5-tosyloxy-indole-3-carboxylic acid ethyl ester Formula: C25H22BrNO5S MolecularWeight: 528.41488

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)C)C4=CC=CC=C4)CBr

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)C)C4=CC=CC=C4)CBr

InChI

InChI=1S/C25H22BrNO5S/c1-3-31-25(28)24-21-15-19(32-33(29,30)20-12-9-17(2)10-13-20)11-14-22(21)27(23(24)16-26)18-7-5-4-6-8-18/h4-15H,3,16H2,1-2H3