3-[[(1S)-1-(2-methoxy-5-methyl-phenyl)ethyl]azaniumyl]propyl-dimethyl-azanium

Systemtic Name: 3-[[(1S)-1-(2-methoxy-5-methyl-phenyl)ethyl]azaniumyl]propyl-dimethyl-azanium Openeye Name: 3-[[(1S)-1-(2-methoxy-5-methyl-phenyl)ethyl]ammonio]propyl-dimethyl-ammonium CAS Name: 3-[[(1S)-1-(2-methoxy-5-methylphenyl)ethyl]ammonio]propyl-dimethylammonium IUPAC Name: 3-[[(1S)-1-(2-methoxy-5-methylphenyl)ethyl]azaniumyl]propyl-dimethylazanium Traditional Name: 3-[[(1S)-1-(2-methoxy-5-methyl-phenyl)ethyl]ammonio]propyl-dimethyl-ammonium Formula: C15H28N2O+2 MolecularWeight: 252.39562

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H26N2O/c1-12-7-8-15(18-5)14(11-12)13(2)16-9-6-10-17(3)4/h7-8,11,13,16H,6,9-10H2,1-5H3/p+2/t13-/m0/s1