ethyl (1R,6R)-6-(furan-2-yl)-4-[3-(methylsulfonylamino)phenyl]-2-oxidanylidene-cyclohex-3-ene-1-carboxylate

Systemtic Name: ethyl (1R,6R)-6-(furan-2-yl)-4-[3-(methylsulfonylamino)phenyl]-2-oxidanylidene-cyclohex-3-ene-1-carboxylate Openeye Name: ethyl (1R,6R)-6-(2-furyl)-4-[3-(methanesulfonamido)phenyl]-2-oxo-cyclohex-3-ene-1-carboxylate CAS Name: (1R,6R)-6-(2-furanyl)-4-[3-(methanesulfonamido)phenyl]-2-oxo-1-cyclohex-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl (1R,6R)-6-(furan-2-yl)-4-[3-(methanesulfonamido)phenyl]-2-oxocyclohex-3-ene-1-carboxylate Traditional Name: (1R,6R)-6-(2-furyl)-2-keto-4-[3-(methanesulfonamido)phenyl]cyclohex-3-ene-1-carboxylic acid ethyl ester Formula: C20H21NO6S MolecularWeight: 403.44884

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(CC(=CC1=O)C2=CC(=CC=C2)NS(=O)(=O)C)C3=CC=CO3

Isomeric SMILES

CCOC(=O)[C@@H]1[C@@H](CC(=CC1=O)C2=CC(=CC=C2)NS(=O)(=O)C)C3=CC=CO3

InChI

InChI=1S/C20H21NO6S/c1-3-26-20(23)19-16(18-8-5-9-27-18)11-14(12-17(19)22)13-6-4-7-15(10-13)21-28(2,24)25/h4-10,12,16,19,21H,3,11H2,1-2H3/t16-,19+/m0/s1