3-[[[2,6-dinitro-4-(trifluoromethyl)phenyl]amino]-phenyl-amino]-N,N-diethyl-propanamide

Systemtic Name: 3-[[[2,6-dinitro-4-(trifluoromethyl)phenyl]amino]-phenyl-amino]-N,N-diethyl-propanamide Openeye Name: 3-(N-[2,6-dinitro-4-(trifluoromethyl)anilino]anilino)-N,N-diethyl-propanamide CAS Name: 3-(N-[2,6-dinitro-4-(trifluoromethyl)anilino]anilino)-N,N-diethylpropanamide IUPAC Name: 3-(N-[2,6-dinitro-4-(trifluoromethyl)anilino]anilino)-N,N-diethylpropanamide Traditional Name: 3-(N-[2,6-dinitro-4-(trifluoromethyl)anilino]anilino)-N,N-diethyl-propionamide Formula: C20H22F3N5O5 MolecularWeight: 469.41439

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CCN(C1=CC=CC=C1)NC2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C(=O)CCN(C1=CC=CC=C1)NC2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C20H22F3N5O5/c1-3-25(4-2)18(29)10-11-26(15-8-6-5-7-9-15)24-19-16(27(30)31)12-14(20(21,22)23)13-17(19)28(32)33/h5-9,12-13,24H,3-4,10-11H2,1-2H3