ethyl 6-(2-ethoxyphenyl)-4-[3-(methylsulfonylamino)phenyl]-2-oxidanylidene-cyclohex-3-ene-1-carboxylate

Systemtic Name: ethyl 6-(2-ethoxyphenyl)-4-[3-(methylsulfonylamino)phenyl]-2-oxidanylidene-cyclohex-3-ene-1-carboxylate Openeye Name: ethyl 6-(2-ethoxyphenyl)-4-[3-(methanesulfonamido)phenyl]-2-oxo-cyclohex-3-ene-1-carboxylate CAS Name: 6-(2-ethoxyphenyl)-4-[3-(methanesulfonamido)phenyl]-2-oxo-1-cyclohex-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl 6-(2-ethoxyphenyl)-4-[3-(methanesulfonamido)phenyl]-2-oxocyclohex-3-ene-1-carboxylate Traditional Name: 2-keto-4-[3-(methanesulfonamido)phenyl]-6-o-phenetyl-cyclohex-3-ene-1-carboxylic acid ethyl ester Formula: C24H27NO6S MolecularWeight: 457.53928

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2CC(=CC(=O)C2C(=O)OCC)C3=CC(=CC=C3)NS(=O)(=O)C

Isomeric SMILES

CCOC1=CC=CC=C1C2CC(=CC(=O)C2C(=O)OCC)C3=CC(=CC=C3)NS(=O)(=O)C

InChI

InChI=1S/C24H27NO6S/c1-4-30-22-12-7-6-11-19(22)20-14-17(15-21(26)23(20)24(27)31-5-2)16-9-8-10-18(13-16)25-32(3,28)29/h6-13,15,20,23,25H,4-5,14H2,1-3H3