3-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-2-[4-(trifluoromethyl)phenyl]inden-1-one

Systemtic Name: 3-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-2-[4-(trifluoromethyl)phenyl]inden-1-one Openeye Name: 3-[3-methyl-4-(m-tolyl)piperazin-1-yl]-2-[4-(trifluoromethyl)phenyl]inden-1-one CAS Name: 3-[3-methyl-4-(3-methylphenyl)-1-piperazinyl]-2-[4-(trifluoromethyl)phenyl]-1-indenone IUPAC Name: 3-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-2-[4-(trifluoromethyl)phenyl]inden-1-one Traditional Name: 3-[3-methyl-4-(m-tolyl)piperazino]-2-[4-(trifluoromethyl)phenyl]inden-1-one Formula: C28H25F3N2O MolecularWeight: 462.50611

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=CC(=C2)C)C3=C(C(=O)C4=CC=CC=C43)C5=CC=C(C=C5)C(F)(F)F

Isomeric SMILES

CC1CN(CCN1C2=CC=CC(=C2)C)C3=C(C(=O)C4=CC=CC=C43)C5=CC=C(C=C5)C(F)(F)F

InChI

InChI=1S/C28H25F3N2O/c1-18-6-5-7-22(16-18)33-15-14-32(17-19(33)2)26-23-8-3-4-9-24(23)27(34)25(26)20-10-12-21(13-11-20)28(29,30)31/h3-13,16,19H,14-15,17H2,1-2H3