7-methoxy-1-[[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]naphthalen-2-ol

Systemtic Name: 7-methoxy-1-[[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]naphthalen-2-ol Openeye Name: 7-methoxy-1-[[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]naphthalen-2-ol CAS Name: 7-methoxy-1-[[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]methyl]-2-naphthalenol IUPAC Name: 7-methoxy-1-[[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]naphthalen-2-ol Traditional Name: 7-methoxy-1-[[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]methyl]-2-naphthol Formula: C23H22F3N3O4 MolecularWeight: 461.43369

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=CC(=C2CN3CCN(CC3)C4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-])O

Isomeric SMILES

COC1=CC2=C(C=C1)C=CC(=C2CN3CCN(CC3)C4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-])O

InChI

InChI=1S/C23H22F3N3O4/c1-33-17-5-2-15-3-7-22(30)19(18(15)13-17)14-27-8-10-28(11-9-27)20-6-4-16(23(24,25)26)12-21(20)29(31)32/h2-7,12-13,30H,8-11,14H2,1H3