N-[(2R)-2-(4-fluoranyl-3-methyl-phenyl)sulfonyl-2-(furan-2-yl)ethyl]-2-methyl-3-nitro-benzamide

Systemtic Name: N-[(2R)-2-(4-fluoranyl-3-methyl-phenyl)sulfonyl-2-(furan-2-yl)ethyl]-2-methyl-3-nitro-benzamide Openeye Name: N-[(2R)-2-(4-fluoro-3-methyl-phenyl)sulfonyl-2-(2-furyl)ethyl]-2-methyl-3-nitro-benzamide CAS Name: N-[(2R)-2-(4-fluoro-3-methylphenyl)sulfonyl-2-(2-furanyl)ethyl]-2-methyl-3-nitrobenzamide IUPAC Name: N-[(2R)-2-(4-fluoro-3-methylphenyl)sulfonyl-2-(furan-2-yl)ethyl]-2-methyl-3-nitrobenzamide Traditional Name: N-[(2R)-2-(4-fluoro-3-methyl-phenyl)sulfonyl-2-(2-furyl)ethyl]-2-methyl-3-nitro-benzamide Formula: C21H19FN2O6S MolecularWeight: 446.448763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)C(CNC(=O)C2=C(C(=CC=C2)[N+](=O)[O-])C)C3=CC=CO3)F

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)[C@H](CNC(=O)C2=C(C(=CC=C2)[N+](=O)[O-])C)C3=CC=CO3)F

InChI

InChI=1S/C21H19FN2O6S/c1-13-11-15(8-9-17(13)22)31(28,29)20(19-7-4-10-30-19)12-23-21(25)16-5-3-6-18(14(16)2)24(26)27/h3-11,20H,12H2,1-2H3,(H,23,25)/t20-/m1/s1