ethyl 3-iodanyl-5-phenylmethoxy-1-(phenylsulfonyl)indole-2-carboxylate

Systemtic Name: ethyl 3-iodanyl-5-phenylmethoxy-1-(phenylsulfonyl)indole-2-carboxylate Openeye Name: ethyl 1-(benzenesulfonyl)-5-benzyloxy-3-iodo-indole-2-carboxylate CAS Name: 1-(benzenesulfonyl)-3-iodo-5-phenylmethoxy-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(benzenesulfonyl)-3-iodo-5-phenylmethoxyindole-2-carboxylate Traditional Name: 5-benzoxy-1-besyl-3-iodo-indole-2-carboxylic acid ethyl ester Formula: C24H20INO5S MolecularWeight: 561.38877

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1S(=O)(=O)C3=CC=CC=C3)C=CC(=C2)OCC4=CC=CC=C4)I

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1S(=O)(=O)C3=CC=CC=C3)C=CC(=C2)OCC4=CC=CC=C4)I

InChI

InChI=1S/C24H20INO5S/c1-2-30-24(27)23-22(25)20-15-18(31-16-17-9-5-3-6-10-17)13-14-21(20)26(23)32(28,29)19-11-7-4-8-12-19/h3-15H,2,16H2,1H3