3-methyl-1-(phenylmethyl)-3-(2-piperidin-1-ium-1-ylethyl)indol-2-one chloride

Systemtic Name: 3-methyl-1-(phenylmethyl)-3-(2-piperidin-1-ium-1-ylethyl)indol-2-one chloride Openeye Name: 1-benzyl-3-methyl-3-(2-piperidin-1-ium-1-ylethyl)indolin-2-one chloride CAS Name: 3-methyl-1-(phenylmethyl)-3-[2-(1-piperidin-1-iumyl)ethyl]-2-indolone chloride IUPAC Name: 1-benzyl-3-methyl-3-(2-piperidin-1-ium-1-ylethyl)indol-2-one chloride Traditional Name: 1-benzyl-3-methyl-3-(2-piperidin-1-ium-1-ylethyl)oxindole chloride Formula: C23H29ClN2O MolecularWeight: 384.94216

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2N(C1=O)CC3=CC=CC=C3)CC[NH+]4CCCCC4.[Cl-]

Isomeric SMILES

CC1(C2=CC=CC=C2N(C1=O)CC3=CC=CC=C3)CC[NH+]4CCCCC4.[Cl-]

InChI

InChI=1S/C23H28N2O.ClH/c1-23(14-17-24-15-8-3-9-16-24)20-12-6-7-13-21(20)25(22(23)26)18-19-10-4-2-5-11-19;/h2,4-7,10-13H,3,8-9,14-18H2,1H3;1H