(2S)-1-(3,4-dimethoxyphenyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)propan-2-amine

Systemtic Name: (2S)-1-(3,4-dimethoxyphenyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)propan-2-amine Openeye Name: (2S)-1-(3,4-dimethoxyphenyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)propan-2-amine CAS Name: (2S)-1-(3,4-dimethoxyphenyl)-N-[2-(1-pyrrolidin-1-iumyl)ethyl]-2-propanamine IUPAC Name: (2S)-1-(3,4-dimethoxyphenyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)propan-2-amine Traditional Name: [(1S)-2-(3,4-dimethoxyphenyl)-1-methyl-ethyl]-(2-pyrrolidin-1-ium-1-ylethyl)amine Formula: C17H29N2O2+ MolecularWeight: 293.42436

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC(=C(C=C1)OC)OC)NCC[NH+]2CCCC2

Isomeric SMILES

C[C@@H](CC1=CC(=C(C=C1)OC)OC)NCC[NH+]2CCCC2

InChI

InChI=1S/C17H28N2O2/c1-14(18-8-11-19-9-4-5-10-19)12-15-6-7-16(20-2)17(13-15)21-3/h6-7,13-14,18H,4-5,8-12H2,1-3H3/p+1/t14-/m0/s1