[4-[5-chloranyl-2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [4-[5-chloranyl-2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-pyrrolidin-1-yl-methanone Openeye Name: [4-[5-chloro-2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-pyrrolidin-1-yl-methanone CAS Name: [4-[5-chloro-2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]-(1-pyrrolidinyl)methanone IUPAC Name: [4-[5-chloro-2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-pyrrolidin-1-ylmethanone Traditional Name: [4-[5-chloro-2-nitro-4-(trifluoromethyl)phenyl]piperazino]-pyrrolidino-methanone Formula: C16H18ClF3N4O3 MolecularWeight: 406.78733

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)N2CCN(CC2)C3=C(C=C(C(=C3)Cl)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C(=O)N2CCN(CC2)C3=C(C=C(C(=C3)Cl)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C16H18ClF3N4O3/c17-12-10-13(14(24(26)27)9-11(12)16(18,19)20)21-5-7-23(8-6-21)15(25)22-3-1-2-4-22/h9-10H,1-8H2