8-[(4-methylpiperazin-4-ium-1-yl)methyl]-3-naphthalen-1-yl-7-oxidanyl-2-(trifluoromethyl)chromen-4-one

Systemtic Name: 8-[(4-methylpiperazin-4-ium-1-yl)methyl]-3-naphthalen-1-yl-7-oxidanyl-2-(trifluoromethyl)chromen-4-one Openeye Name: 7-hydroxy-8-[(4-methylpiperazin-4-ium-1-yl)methyl]-3-(1-naphthyl)-2-(trifluoromethyl)chromen-4-one CAS Name: 7-hydroxy-8-[(4-methyl-1-piperazin-4-iumyl)methyl]-3-(1-naphthalenyl)-2-(trifluoromethyl)-1-benzopyran-4-one IUPAC Name: 7-hydroxy-8-[(4-methylpiperazin-4-ium-1-yl)methyl]-3-naphthalen-1-yl-2-(trifluoromethyl)chromen-4-one Traditional Name: 7-hydroxy-8-[(4-methylpiperazin-4-ium-1-yl)methyl]-3-(1-naphthyl)-2-(trifluoromethyl)chromone Formula: C26H24F3N2O3+ MolecularWeight: 469.47557

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CC2=C(C=CC3=C2OC(=C(C3=O)C4=CC=CC5=CC=CC=C54)C(F)(F)F)O

Isomeric SMILES

C[NH+]1CCN(CC1)CC2=C(C=CC3=C2OC(=C(C3=O)C4=CC=CC5=CC=CC=C54)C(F)(F)F)O

InChI

InChI=1S/C26H23F3N2O3/c1-30-11-13-31(14-12-30)15-20-21(32)10-9-19-23(33)22(25(26(27,28)29)34-24(19)20)18-8-4-6-16-5-2-3-7-17(16)18/h2-10,32H,11-15H2,1H3/p+1