N-[(R)-(4-fluorophenyl)-thiophen-2-yl-methyl]-2-(5-methyl-2-nitro-phenoxy)ethanamide

Systemtic Name: N-[(R)-(4-fluorophenyl)-thiophen-2-yl-methyl]-2-(5-methyl-2-nitro-phenoxy)ethanamide Openeye Name: N-[(R)-(4-fluorophenyl)-(2-thienyl)methyl]-2-(5-methyl-2-nitro-phenoxy)acetamide CAS Name: N-[(R)-(4-fluorophenyl)-thiophen-2-ylmethyl]-2-(5-methyl-2-nitrophenoxy)acetamide IUPAC Name: N-[(R)-(4-fluorophenyl)-thiophen-2-ylmethyl]-2-(5-methyl-2-nitrophenoxy)acetamide Traditional Name: N-[(R)-(4-fluorophenyl)-(2-thienyl)methyl]-2-(5-methyl-2-nitro-phenoxy)acetamide Formula: C20H17FN2O4S MolecularWeight: 400.423383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)[N+](=O)[O-])OCC(=O)NC(C2=CC=C(C=C2)F)C3=CC=CS3

Isomeric SMILES

CC1=CC(=C(C=C1)[N+](=O)[O-])OCC(=O)N[C@H](C2=CC=C(C=C2)F)C3=CC=CS3

InChI

InChI=1S/C20H17FN2O4S/c1-13-4-9-16(23(25)26)17(11-13)27-12-19(24)22-20(18-3-2-10-28-18)14-5-7-15(21)8-6-14/h2-11,20H,12H2,1H3,(H,22,24)/t20-/m1/s1