[(2R)-1-[(2S)-1-(3,4-dimethoxyphenyl)propan-2-yl]pyrrolidin-1-ium-2-yl]methanol

Systemtic Name: [(2R)-1-[(2S)-1-(3,4-dimethoxyphenyl)propan-2-yl]pyrrolidin-1-ium-2-yl]methanol Openeye Name: [(2R)-1-[(1S)-2-(3,4-dimethoxyphenyl)-1-methyl-ethyl]pyrrolidin-1-ium-2-yl]methanol CAS Name: [(2R)-1-[(2S)-1-(3,4-dimethoxyphenyl)propan-2-yl]-2-pyrrolidin-1-iumyl]methanol IUPAC Name: [(2R)-1-[(2S)-1-(3,4-dimethoxyphenyl)propan-2-yl]pyrrolidin-1-ium-2-yl]methanol Traditional Name: [(2R)-1-[(1S)-2-(3,4-dimethoxyphenyl)-1-methyl-ethyl]pyrrolidin-1-ium-2-yl]methanol Formula: C16H26NO3+ MolecularWeight: 280.38254

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC(=C(C=C1)OC)OC)[NH+]2CCCC2CO

Isomeric SMILES

C[C@@H](CC1=CC(=C(C=C1)OC)OC)[NH+]2CCC[C@@H]2CO

InChI

InChI=1S/C16H25NO3/c1-12(17-8-4-5-14(17)11-18)9-13-6-7-15(19-2)16(10-13)20-3/h6-7,10,12,14,18H,4-5,8-9,11H2,1-3H3/p+1/t12-,14+/m0/s1