5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-N-[(E)-heptylideneamino]-2-nitro-aniline

Systemtic Name: 5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-N-[(E)-heptylideneamino]-2-nitro-aniline Openeye Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-N-[(E)-heptylideneamino]-2-nitro-aniline CAS Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-N-[(E)-heptylideneamino]-2-nitroaniline IUPAC Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-N-[(E)-heptylideneamino]-2-nitroaniline Traditional Name: [5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-phenyl]-[(E)-heptylideneamino]amine Formula: C20H21ClF3N3O3 MolecularWeight: 443.84725

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC=NNC1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCCCC/C=N/NC1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H21ClF3N3O3/c1-2-3-4-5-6-11-25-26-17-13-15(8-9-18(17)27(28)29)30-19-10-7-14(12-16(19)21)20(22,23)24/h7-13,26H,2-6H2,1H3/b25-11+