1-[[(2S)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]naphthalen-2-ol

Systemtic Name: 1-[[(2S)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]naphthalen-2-ol Openeye Name: 1-[[(2S)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]naphthalen-2-ol CAS Name: 1-[[(2S)-2-(2,5-dimethoxyphenyl)-1-pyrrolidin-1-iumyl]methyl]-2-naphthalenol IUPAC Name: 1-[[(2S)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]naphthalen-2-ol Traditional Name: 1-[[(2S)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]-2-naphthol Formula: C23H26NO3+ MolecularWeight: 364.45744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2CCC[NH+]2CC3=C(C=CC4=CC=CC=C43)O

Isomeric SMILES

COC1=CC(=C(C=C1)OC)[C@@H]2CCC[NH+]2CC3=C(C=CC4=CC=CC=C43)O

InChI

InChI=1S/C23H25NO3/c1-26-17-10-12-23(27-2)19(14-17)21-8-5-13-24(21)15-20-18-7-4-3-6-16(18)9-11-22(20)25/h3-4,6-7,9-12,14,21,25H,5,8,13,15H2,1-2H3/p+1/t21-/m0/s1