ethyl 1-(4-chlorophenyl)-2-methyl-5-(4-methylphenyl)sulfonyloxy-indole-3-carboxylate

Systemtic Name: ethyl 1-(4-chlorophenyl)-2-methyl-5-(4-methylphenyl)sulfonyloxy-indole-3-carboxylate Openeye Name: ethyl 1-(4-chlorophenyl)-2-methyl-5-(p-tolylsulfonyloxy)indole-3-carboxylate CAS Name: 1-(4-chlorophenyl)-2-methyl-5-(4-methylphenyl)sulfonyloxy-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-chlorophenyl)-2-methyl-5-(4-methylphenyl)sulfonyloxyindole-3-carboxylate Traditional Name: 1-(4-chlorophenyl)-2-methyl-5-tosyloxy-indole-3-carboxylic acid ethyl ester Formula: C25H22ClNO5S MolecularWeight: 483.96388

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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=C(C=C4)Cl)C

Isomeric SMILES

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

InChI

InChI=1S/C25H22ClNO5S/c1-4-31-25(28)24-17(3)27(19-9-7-18(26)8-10-19)23-14-11-20(15-22(23)24)32-33(29,30)21-12-5-16(2)6-13-21/h5-15H,4H2,1-3H3