(3,5-dimethoxy-4-oxidanyl-phenyl)methyl-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]azanium

Systemtic Name: (3,5-dimethoxy-4-oxidanyl-phenyl)methyl-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]azanium Openeye Name: [(2S)-1-ethylpyrrolidin-2-yl]methyl-[(4-hydroxy-3,5-dimethoxy-phenyl)methyl]ammonium CAS Name: [(2S)-1-ethyl-2-pyrrolidinyl]methyl-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]ammonium IUPAC Name: [(2S)-1-ethylpyrrolidin-2-yl]methyl-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]azanium Traditional Name: [(2S)-1-ethylpyrrolidin-2-yl]methyl-(4-hydroxy-3,5-dimethoxy-benzyl)ammonium Formula: C16H27N2O3+ MolecularWeight: 295.39718

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1C[NH2+]CC2=CC(=C(C(=C2)OC)O)OC

Isomeric SMILES

CCN1CCC[C@H]1C[NH2+]CC2=CC(=C(C(=C2)OC)O)OC

InChI

InChI=1S/C16H26N2O3/c1-4-18-7-5-6-13(18)11-17-10-12-8-14(20-2)16(19)15(9-12)21-3/h8-9,13,17,19H,4-7,10-11H2,1-3H3/p+1/t13-/m0/s1