N-[[2,4-bis(fluoranyl)-5-nitro-phenyl]methyl]-1-cyclopentyl-methanamine

Systemtic Name: N-[[2,4-bis(fluoranyl)-5-nitro-phenyl]methyl]-1-cyclopentyl-methanamine Openeye Name: 1-cyclopentyl-N-[(2,4-difluoro-5-nitro-phenyl)methyl]methanamine CAS Name: 1-cyclopentyl-N-[(2,4-difluoro-5-nitrophenyl)methyl]methanamine IUPAC Name: 1-cyclopentyl-N-[(2,4-difluoro-5-nitrophenyl)methyl]methanamine Traditional Name: cyclopentylmethyl-(2,4-difluoro-5-nitro-benzyl)amine Formula: C13H16F2N2O2 MolecularWeight: 270.275146

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CNCC2=CC(=C(C=C2F)F)[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)CNCC2=CC(=C(C=C2F)F)[N+](=O)[O-]

InChI

InChI=1S/C13H16F2N2O2/c14-11-6-12(15)13(17(18)19)5-10(11)8-16-7-9-3-1-2-4-9/h5-6,9,16H,1-4,7-8H2