1-[[(3R)-3-methylpiperidin-1-ium-1-yl]methyl]-3-[4-(trifluoromethyloxy)phenyl]imino-indol-2-one

Systemtic Name: 1-[[(3R)-3-methylpiperidin-1-ium-1-yl]methyl]-3-[4-(trifluoromethyloxy)phenyl]imino-indol-2-one Openeye Name: 1-[[(3R)-3-methylpiperidin-1-ium-1-yl]methyl]-3-[4-(trifluoromethoxy)phenyl]imino-indolin-2-one CAS Name: 1-[[(3R)-3-methyl-1-piperidin-1-iumyl]methyl]-3-[4-(trifluoromethoxy)phenyl]imino-2-indolone IUPAC Name: 1-[[(3R)-3-methylpiperidin-1-ium-1-yl]methyl]-3-[4-(trifluoromethoxy)phenyl]iminoindol-2-one Traditional Name: 1-[[(3R)-3-methylpiperidin-1-ium-1-yl]methyl]-3-[4-(trifluoromethoxy)phenyl]imino-oxindole Formula: C22H23F3N3O2+ MolecularWeight: 418.43213

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CN2C3=CC=CC=C3C(=NC4=CC=C(C=C4)OC(F)(F)F)C2=O

Isomeric SMILES

C[C@@H]1CCC[NH+](C1)CN2C3=CC=CC=C3C(=NC4=CC=C(C=C4)OC(F)(F)F)C2=O

InChI

InChI=1S/C22H22F3N3O2/c1-15-5-4-12-27(13-15)14-28-19-7-3-2-6-18(19)20(21(28)29)26-16-8-10-17(11-9-16)30-22(23,24)25/h2-3,6-11,15H,4-5,12-14H2,1H3/p+1/t15-/m1/s1