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

Systemtic Name: 1-[[(3R)-3-methylpiperidin-1-ium-1-yl]methyl]-3-[3-(trifluoromethyl)phenyl]imino-indol-2-one Openeye Name: 1-[[(3R)-3-methylpiperidin-1-ium-1-yl]methyl]-3-[3-(trifluoromethyl)phenyl]imino-indolin-2-one CAS Name: 1-[[(3R)-3-methyl-1-piperidin-1-iumyl]methyl]-3-[3-(trifluoromethyl)phenyl]imino-2-indolone IUPAC Name: 1-[[(3R)-3-methylpiperidin-1-ium-1-yl]methyl]-3-[3-(trifluoromethyl)phenyl]iminoindol-2-one Traditional Name: 1-[[(3R)-3-methylpiperidin-1-ium-1-yl]methyl]-3-[3-(trifluoromethyl)phenyl]imino-oxindole Formula: C22H23F3N3O+ MolecularWeight: 402.43273

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22F3N3O/c1-15-6-5-11-27(13-15)14-28-19-10-3-2-9-18(19)20(21(28)29)26-17-8-4-7-16(12-17)22(23,24)25/h2-4,7-10,12,15H,5-6,11,13-14H2,1H3/p+1/t15-/m1/s1