4-nitro-N-propyl-2-[4-[3-(trifluoromethyl)phenyl]-1,3-benzoxazol-2-yl]aniline

Systemtic Name: 4-nitro-N-propyl-2-[4-[3-(trifluoromethyl)phenyl]-1,3-benzoxazol-2-yl]aniline Openeye Name: 4-nitro-N-propyl-2-[4-[3-(trifluoromethyl)phenyl]-1,3-benzoxazol-2-yl]aniline CAS Name: 4-nitro-N-propyl-2-[4-[3-(trifluoromethyl)phenyl]-1,3-benzoxazol-2-yl]aniline IUPAC Name: 4-nitro-N-propyl-2-[4-[3-(trifluoromethyl)phenyl]-1,3-benzoxazol-2-yl]aniline Traditional Name: [4-nitro-2-[4-[3-(trifluoromethyl)phenyl]-1,3-benzoxazol-2-yl]phenyl]-propyl-amine Formula: C23H18F3N3O3 MolecularWeight: 441.40253

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C(C=C(C=C1)[N+](=O)[O-])C2=NC3=C(C=CC=C3O2)C4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

CCCNC1=C(C=C(C=C1)[N+](=O)[O-])C2=NC3=C(C=CC=C3O2)C4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C23H18F3N3O3/c1-2-11-27-19-10-9-16(29(30)31)13-18(19)22-28-21-17(7-4-8-20(21)32-22)14-5-3-6-15(12-14)23(24,25)26/h3-10,12-13,27H,2,11H2,1H3