ethyl 6-[5-methylsulfonyl-1-(phenylsulfonyl)indol-2-yl]pyridine-3-carboxylate

Systemtic Name: ethyl 6-[5-methylsulfonyl-1-(phenylsulfonyl)indol-2-yl]pyridine-3-carboxylate Openeye Name: ethyl 6-[1-(benzenesulfonyl)-5-methylsulfonyl-indol-2-yl]pyridine-3-carboxylate CAS Name: 6-[1-(benzenesulfonyl)-5-methylsulfonyl-2-indolyl]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[1-(benzenesulfonyl)-5-methylsulfonylindol-2-yl]pyridine-3-carboxylate Traditional Name: 6-(1-besyl-5-mesyl-indol-2-yl)nicotinic acid ethyl ester Formula: C23H20N2O6S2 MolecularWeight: 484.5447

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(C=C1)C2=CC3=C(N2S(=O)(=O)C4=CC=CC=C4)C=CC(=C3)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=CN=C(C=C1)C2=CC3=C(N2S(=O)(=O)C4=CC=CC=C4)C=CC(=C3)S(=O)(=O)C

InChI

InChI=1S/C23H20N2O6S2/c1-3-31-23(26)16-9-11-20(24-15-16)22-14-17-13-19(32(2,27)28)10-12-21(17)25(22)33(29,30)18-7-5-4-6-8-18/h4-15H,3H2,1-2H3