N-[(1R)-1-cyano-1-cyclopropyl-ethyl]-2-[2-(4-methoxyphenyl)-4-nitro-phenoxy]ethanamide

Systemtic Name: N-[(1R)-1-cyano-1-cyclopropyl-ethyl]-2-[2-(4-methoxyphenyl)-4-nitro-phenoxy]ethanamide Openeye Name: N-[(1R)-1-cyano-1-cyclopropyl-ethyl]-2-[2-(4-methoxyphenyl)-4-nitro-phenoxy]acetamide CAS Name: N-[(1R)-1-cyano-1-cyclopropylethyl]-2-[2-(4-methoxyphenyl)-4-nitrophenoxy]acetamide IUPAC Name: N-[(1R)-1-cyano-1-cyclopropylethyl]-2-[2-(4-methoxyphenyl)-4-nitrophenoxy]acetamide Traditional Name: N-[(1R)-1-cyano-1-cyclopropyl-ethyl]-2-[2-(4-methoxyphenyl)-4-nitro-phenoxy]acetamide Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)(C1CC1)NC(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)OC

Isomeric SMILES

C[C@](C#N)(C1CC1)NC(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H21N3O5/c1-21(13-22,15-5-6-15)23-20(25)12-29-19-10-7-16(24(26)27)11-18(19)14-3-8-17(28-2)9-4-14/h3-4,7-11,15H,5-6,12H2,1-2H3,(H,23,25)/t21-/m0/s1