2-nitro-N-[(E)-1-(10H-phenothiazin-2-yl)ethylideneamino]-4-(trifluoromethyl)aniline

Systemtic Name: 2-nitro-N-[(E)-1-(10H-phenothiazin-2-yl)ethylideneamino]-4-(trifluoromethyl)aniline Openeye Name: 2-nitro-N-[(E)-1-(10H-phenothiazin-2-yl)ethylideneamino]-4-(trifluoromethyl)aniline CAS Name: 2-nitro-N-[(E)-1-(10H-phenothiazin-2-yl)ethylideneamino]-4-(trifluoromethyl)aniline IUPAC Name: 2-nitro-N-[(E)-1-(10H-phenothiazin-2-yl)ethylideneamino]-4-(trifluoromethyl)aniline Traditional Name: [2-nitro-4-(trifluoromethyl)phenyl]-[(E)-1-(10H-phenothiazin-2-yl)ethylideneamino]amine Formula: C21H15F3N4O2S MolecularWeight: 444.42961

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-])C2=CC3=C(C=C2)SC4=CC=CC=C4N3

Isomeric SMILES

C/C(=N\NC1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-])/C2=CC3=C(C=C2)SC4=CC=CC=C4N3

InChI

InChI=1S/C21H15F3N4O2S/c1-12(26-27-15-8-7-14(21(22,23)24)11-18(15)28(29)30)13-6-9-20-17(10-13)25-16-4-2-3-5-19(16)31-20/h2-11,25,27H,1H3/b26-12+