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

Systemtic Name: 1-[[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]naphthalen-2-ol Openeye Name: 1-[[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]naphthalen-2-ol CAS Name: 1-[[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]methyl]-2-naphthalenol IUPAC Name: 1-[[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]naphthalen-2-ol Traditional Name: 1-[[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]methyl]-2-naphthol Formula: C22H20F3N3O3 MolecularWeight: 431.40771

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C(C=CC3=CC=CC=C32)O)C4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=C(C=CC3=CC=CC=C32)O)C4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C22H20F3N3O3/c23-22(24,25)16-6-7-19(20(13-16)28(30)31)27-11-9-26(10-12-27)14-18-17-4-2-1-3-15(17)5-8-21(18)29/h1-8,13,29H,9-12,14H2