3-[[(2S)-1-(4-methoxyphenyl)propan-2-yl]azaniumyl]propyl-dimethyl-azanium

Systemtic Name: 3-[[(2S)-1-(4-methoxyphenyl)propan-2-yl]azaniumyl]propyl-dimethyl-azanium Openeye Name: 3-[[(1S)-2-(4-methoxyphenyl)-1-methyl-ethyl]ammonio]propyl-dimethyl-ammonium CAS Name: 3-[[(2S)-1-(4-methoxyphenyl)propan-2-yl]ammonio]propyl-dimethylammonium IUPAC Name: 3-[[(2S)-1-(4-methoxyphenyl)propan-2-yl]azaniumyl]propyl-dimethylazanium Traditional Name: 3-[[(1S)-2-(4-methoxyphenyl)-1-methyl-ethyl]ammonio]propyl-dimethyl-ammonium Formula: C15H28N2O+2 MolecularWeight: 252.39562

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=C(C=C1)OC)[NH2+]CCC[NH+](C)C

Isomeric SMILES

C[C@@H](CC1=CC=C(C=C1)OC)[NH2+]CCC[NH+](C)C

InChI

InChI=1S/C15H26N2O/c1-13(16-10-5-11-17(2)3)12-14-6-8-15(18-4)9-7-14/h6-9,13,16H,5,10-12H2,1-4H3/p+2/t13-/m0/s1