2-[[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]indolizine-1-carbonitrile

Systemtic Name: 2-[[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]indolizine-1-carbonitrile Openeye Name: 2-[[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]indolizine-1-carbonitrile CAS Name: 2-[[(2R)-2-(2,4-dimethoxyphenyl)-1-pyrrolidin-1-iumyl]methyl]-1-indolizinecarbonitrile IUPAC Name: 2-[[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]indolizine-1-carbonitrile Traditional Name: 2-[[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]indolizine-1-carbonitrile Formula: C22H24N3O2+ MolecularWeight: 362.44486

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2CCC[NH+]2CC3=CN4C=CC=CC4=C3C#N)OC

Isomeric SMILES

COC1=CC(=C(C=C1)[C@H]2CCC[NH+]2CC3=CN4C=CC=CC4=C3C#N)OC

InChI

InChI=1S/C22H23N3O2/c1-26-17-8-9-18(22(12-17)27-2)20-7-5-11-25(20)15-16-14-24-10-4-3-6-21(24)19(16)13-23/h3-4,6,8-10,12,14,20H,5,7,11,15H2,1-2H3/p+1/t20-/m1/s1