N-[(2R)-2-(4-fluoranyl-3-methyl-phenyl)sulfonyl-2-(furan-2-yl)ethyl]-4,5-dimethoxy-2-nitro-benzamide

Systemtic Name: N-[(2R)-2-(4-fluoranyl-3-methyl-phenyl)sulfonyl-2-(furan-2-yl)ethyl]-4,5-dimethoxy-2-nitro-benzamide Openeye Name: N-[(2R)-2-(4-fluoro-3-methyl-phenyl)sulfonyl-2-(2-furyl)ethyl]-4,5-dimethoxy-2-nitro-benzamide CAS Name: N-[(2R)-2-(4-fluoro-3-methylphenyl)sulfonyl-2-(2-furanyl)ethyl]-4,5-dimethoxy-2-nitrobenzamide IUPAC Name: N-[(2R)-2-(4-fluoro-3-methylphenyl)sulfonyl-2-(furan-2-yl)ethyl]-4,5-dimethoxy-2-nitrobenzamide Traditional Name: N-[(2R)-2-(4-fluoro-3-methyl-phenyl)sulfonyl-2-(2-furyl)ethyl]-4,5-dimethoxy-2-nitro-benzamide Formula: C22H21FN2O8S MolecularWeight: 492.474143

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21FN2O8S/c1-13-9-14(6-7-16(13)23)34(29,30)21(18-5-4-8-33-18)12-24-22(26)15-10-19(31-2)20(32-3)11-17(15)25(27)28/h4-11,21H,12H2,1-3H3,(H,24,26)/t21-/m1/s1