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

Systemtic Name: N-[5-chloranyl-2-(trifluoromethyl)phenyl]-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[5-chloro-2-(trifluoromethyl)phenyl]-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[5-chloro-2-(trifluoromethyl)phenyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[5-chloro-2-(trifluoromethyl)phenyl]-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-[5-chloro-2-(trifluoromethyl)phenyl]-3-nitro-4-pyrrolidino-benzamide Formula: C18H15ClF3N3O3 MolecularWeight: 413.77821

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NC3=C(C=CC(=C3)Cl)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NC3=C(C=CC(=C3)Cl)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C18H15ClF3N3O3/c19-12-4-5-13(18(20,21)22)14(10-12)23-17(26)11-3-6-15(16(9-11)25(27)28)24-7-1-2-8-24/h3-6,9-10H,1-2,7-8H2,(H,23,26)