N-[5-chloranyl-2,3,3-tris(fluoranyl)-1,1-dinitro-2-propyl-pentyl]-4-methyl-aniline

Systemtic Name: N-[5-chloranyl-2,3,3-tris(fluoranyl)-1,1-dinitro-2-propyl-pentyl]-4-methyl-aniline Openeye Name: N-(5-chloro-2,3,3-trifluoro-1,1-dinitro-2-propyl-pentyl)-4-methyl-aniline CAS Name: N-(5-chloro-2,3,3-trifluoro-1,1-dinitro-2-propylpentyl)-4-methylaniline IUPAC Name: N-(5-chloro-2,3,3-trifluoro-1,1-dinitro-2-propylpentyl)-4-methylaniline Traditional Name: (5-chloro-2,3,3-trifluoro-1,1-dinitro-2-propyl-pentyl)-(p-tolyl)amine Formula: C15H19ClF3N3O4 MolecularWeight: 397.77727

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CCCl)(F)F)(C(NC1=CC=C(C=C1)C)([N+](=O)[O-])[N+](=O)[O-])F

Isomeric SMILES

CCCC(C(CCCl)(F)F)(C(NC1=CC=C(C=C1)C)([N+](=O)[O-])[N+](=O)[O-])F

InChI

InChI=1S/C15H19ClF3N3O4/c1-3-8-13(17,14(18,19)9-10-16)15(21(23)24,22(25)26)20-12-6-4-11(2)5-7-12/h4-7,20H,3,8-10H2,1-2H3