2,6,8-trimethyl-4-[[(2S)-2-pyridin-2-ylpyrrolidin-1-ium-1-yl]methyl]quinoline

Systemtic Name: 2,6,8-trimethyl-4-[[(2S)-2-pyridin-2-ylpyrrolidin-1-ium-1-yl]methyl]quinoline Openeye Name: 2,6,8-trimethyl-4-[[(2S)-2-(2-pyridyl)pyrrolidin-1-ium-1-yl]methyl]quinoline CAS Name: 2,6,8-trimethyl-4-[[(2S)-2-(2-pyridinyl)-1-pyrrolidin-1-iumyl]methyl]quinoline IUPAC Name: 2,6,8-trimethyl-4-[[(2S)-2-pyridin-2-ylpyrrolidin-1-ium-1-yl]methyl]quinoline Traditional Name: 2,6,8-trimethyl-4-[[(2S)-2-(2-pyridyl)pyrrolidin-1-ium-1-yl]methyl]quinoline Formula: C22H26N3+ MolecularWeight: 332.46194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)C)C[NH+]3CCCC3C4=CC=CC=N4)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)C)C[NH+]3CCC[C@H]3C4=CC=CC=N4)C

InChI

InChI=1S/C22H25N3/c1-15-11-16(2)22-19(12-15)18(13-17(3)24-22)14-25-10-6-8-21(25)20-7-4-5-9-23-20/h4-5,7,9,11-13,21H,6,8,10,14H2,1-3H3/p+1/t21-/m0/s1