ethyl 5-bromanyl-1-(4-methylphenyl)sulfonyl-indole-2-carboxylate

Systemtic Name: ethyl 5-bromanyl-1-(4-methylphenyl)sulfonyl-indole-2-carboxylate Openeye Name: ethyl 5-bromo-1-(p-tolylsulfonyl)indole-2-carboxylate CAS Name: 5-bromo-1-(4-methylphenyl)sulfonyl-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-bromo-1-(4-methylphenyl)sulfonylindole-2-carboxylate Traditional Name: 5-bromo-1-tosyl-indole-2-carboxylic acid ethyl ester Formula: C18H16BrNO4S MolecularWeight: 422.29294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(N1S(=O)(=O)C3=CC=C(C=C3)C)C=CC(=C2)Br

Isomeric SMILES

CCOC(=O)C1=CC2=C(N1S(=O)(=O)C3=CC=C(C=C3)C)C=CC(=C2)Br

InChI

InChI=1S/C18H16BrNO4S/c1-3-24-18(21)17-11-13-10-14(19)6-9-16(13)20(17)25(22,23)15-7-4-12(2)5-8-15/h4-11H,3H2,1-2H3