8-[[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-ium-1-yl]methyl]quinoline

Systemtic Name: 8-[[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-ium-1-yl]methyl]quinoline Openeye Name: 8-[[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-ium-1-yl]methyl]quinoline CAS Name: 8-[[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-pyrrolidin-1-iumyl]methyl]quinoline IUPAC Name: 8-[[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-ium-1-yl]methyl]quinoline Traditional Name: 8-[[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-ium-1-yl]methyl]quinoline Formula: C22H23N2O2+ MolecularWeight: 347.43022

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH+](C1)CC2=CC=CC3=C2N=CC=C3)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

C1C[C@@H]([NH+](C1)CC2=CC=CC3=C2N=CC=C3)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C22H22N2O2/c1-4-16-6-2-10-23-22(16)18(5-1)15-24-11-3-7-19(24)17-8-9-20-21(14-17)26-13-12-25-20/h1-2,4-6,8-10,14,19H,3,7,11-13,15H2/p+1/t19-/m1/s1