[(2S)-2-(azaniumylmethyl)-3-(2,5-dimethoxyphenyl)propyl]-diethyl-azanium

Systemtic Name: [(2S)-2-(azaniumylmethyl)-3-(2,5-dimethoxyphenyl)propyl]-diethyl-azanium Openeye Name: [(2S)-2-(azaniumylmethyl)-3-(2,5-dimethoxyphenyl)propyl]-diethyl-ammonium CAS Name: [(2S)-2-(ammoniomethyl)-3-(2,5-dimethoxyphenyl)propyl]-diethylammonium IUPAC Name: [(2S)-2-(azaniumylmethyl)-3-(2,5-dimethoxyphenyl)propyl]-diethylazanium Traditional Name: [(2S)-2-(ammoniomethyl)-3-(2,5-dimethoxyphenyl)propyl]-diethyl-ammonium Formula: C16H30N2O2+2 MolecularWeight: 282.4216

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC(CC1=C(C=CC(=C1)OC)OC)C[NH3+]

Isomeric SMILES

CC[NH+](CC)C[C@@H](CC1=C(C=CC(=C1)OC)OC)C[NH3+]

InChI

InChI=1S/C16H28N2O2/c1-5-18(6-2)12-13(11-17)9-14-10-15(19-3)7-8-16(14)20-4/h7-8,10,13H,5-6,9,11-12,17H2,1-4H3/p+2/t13-/m0/s1