N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-3-nitro-4-pyrrolidino-benzamide Formula: C21H22F3N3O5 MolecularWeight: 453.41169

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C=C1)C(F)(F)F)NC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

COCCOC1=C(C=C(C=C1)C(F)(F)F)NC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C21H22F3N3O5/c1-31-10-11-32-19-7-5-15(21(22,23)24)13-16(19)25-20(28)14-4-6-17(18(12-14)27(29)30)26-8-2-3-9-26/h4-7,12-13H,2-3,8-11H2,1H3,(H,25,28)