N'-(5-nitroquinolin-8-yl)-N-[2-nitro-4-(trifluoromethyl)phenyl]ethane-1,2-diamine

Systemtic Name: N'-(5-nitroquinolin-8-yl)-N-[2-nitro-4-(trifluoromethyl)phenyl]ethane-1,2-diamine Openeye Name: N'-(5-nitro-8-quinolyl)-N-[2-nitro-4-(trifluoromethyl)phenyl]ethane-1,2-diamine CAS Name: N'-(5-nitro-8-quinolinyl)-N-[2-nitro-4-(trifluoromethyl)phenyl]ethane-1,2-diamine IUPAC Name: N'-(5-nitroquinolin-8-yl)-N-[2-nitro-4-(trifluoromethyl)phenyl]ethane-1,2-diamine Traditional Name: (5-nitro-8-quinolyl)-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]amine Formula: C18H14F3N5O4 MolecularWeight: 421.33007

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2N=C1)NCCNC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=CC(=C2N=C1)NCCNC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H14F3N5O4/c19-18(20,21)11-3-4-13(16(10-11)26(29)30)22-8-9-23-14-5-6-15(25(27)28)12-2-1-7-24-17(12)14/h1-7,10,22-23H,8-9H2