1-[methyl-(phenylmethyl)amino]-3-phenyl-3-(4-piperidin-1-ium-1-ylbutyl)indol-2-one chloride

Systemtic Name: 1-[methyl-(phenylmethyl)amino]-3-phenyl-3-(4-piperidin-1-ium-1-ylbutyl)indol-2-one chloride Openeye Name: 1-[benzyl(methyl)amino]-3-phenyl-3-(4-piperidin-1-ium-1-ylbutyl)indolin-2-one chloride CAS Name: 1-[methyl-(phenylmethyl)amino]-3-phenyl-3-[4-(1-piperidin-1-iumyl)butyl]-2-indolone chloride IUPAC Name: 1-[benzyl(methyl)amino]-3-phenyl-3-(4-piperidin-1-ium-1-ylbutyl)indol-2-one chloride Traditional Name: 1-[benzyl(methyl)amino]-3-phenyl-3-(4-piperidin-1-ium-1-ylbutyl)oxindole chloride Formula: C31H38ClN3O MolecularWeight: 504.10592

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)N2C3=CC=CC=C3C(C2=O)(CCCC[NH+]4CCCCC4)C5=CC=CC=C5.[Cl-]

Isomeric SMILES

CN(CC1=CC=CC=C1)N2C3=CC=CC=C3C(C2=O)(CCCC[NH+]4CCCCC4)C5=CC=CC=C5.[Cl-]

InChI

InChI=1S/C31H37N3O.ClH/c1-32(25-26-15-5-2-6-16-26)34-29-20-10-9-19-28(29)31(30(34)35,27-17-7-3-8-18-27)21-11-14-24-33-22-12-4-13-23-33;/h2-3,5-10,15-20H,4,11-14,21-25H2,1H3;1H